(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid

Modify Date: 2024-01-09 19:22:30

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure
(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid structure
Common Name (S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid
CAS Number 697762-60-0 Molecular Weight 447.24000
Density N/A Boiling Point N/A
Molecular Formula C17H19FINO4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (S)-Ethyl 7-fluoro-1-(1-hydroxy-3-methylbutan-2-yl)-6-iodo-4-oxo-1,4-dihydroquinoline-3-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C17H19FINO4
Molecular Weight 447.24000
Exact Mass 447.03400
PSA 68.53000
LogP 3.11130

 Safety Information

HS Code 2933499090

 Synthetic Route

~82%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: SATOH, Motohide; Aramaki, Hisateru; Yamashita, Masaki; Inoue, Masafumi; Kawakami, Hiroshi; Shinkai, Hisashi; Nakamura, Hiroshi; Matsuzaki, Yuji; Wamaki, Shuichi Patent: US2008/207618 A1, 2008 ; Location in patent: Page/Page column 33-34 ;

~85%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: CONCERT PHARMACEUTICALS, INC. Patent: WO2009/35662 A1, 2009 ; Location in patent: Page/Page column 21-24 ;

~77%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: JAPAN TOBACCO INC. Patent: WO2005/113508 A1, 2005 ; Location in patent: Page/Page column 13-14; 19; 24-25; 47 ;

~94%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: JAPAN TOBACCO INC. Patent: WO2005/113508 A1, 2005 ; Location in patent: Page/Page column 42 ;

~%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: Sato, Motohide; Motomura, Takahisa; Aramaki, Hisateru; Matsuda, Takashi; Yamashita, Masaki; Ito, Yoshiharu; Kawakami, Hiroshi; Matsuzaki, Yuji; Watanabe, Wataru; Yamataka, Kazunobu; Ikeda, Satoru; Kodama, Eiichi; Matsuoka, Masao; Shinkai, Hisashi Journal of Medicinal Chemistry, 2006 , vol. 49, # 5 p. 1506 - 1508

~%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: MATRIX LABORATORIES LTD; VELLANKI, Siva, Rama, Prasad; DHAKE, Vilas, Nathu; RAVI, Satyanarayana; NUCHU, Ravi; PULIYALA, Ravindra; SHAIK, Mahaboob, Basha; DATTA, Debashish Patent: WO2011/4389 A2, 2011 ;

~%

(S)-7-Fluoro-1-(1-hydroxymethyl-2-methyl-propyl)-6-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid Structure

(S)-7-Fluoro-1-...

CAS#:697762-60-0

Literature: MATRIX LABORATORIES LTD; VELLANKI, Siva, Rama, Prasad; DHAKE, Vilas, Nathu; RAVI, Satyanarayana; NUCHU, Ravi; PULIYALA, Ravindra; SHAIK, Mahaboob, Basha; DATTA, Debashish Patent: WO2011/4389 A2, 2011 ;

 Customs

HS Code 2933499090
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

ethyl 7-fluoro-1-[(2S)-1-hydroxy-3-methylbutan-2-yl]-6-iodo-4-oxoquinoline-3-carboxylate