(5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one

Modify Date: 2024-01-09 17:29:51

(5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one Structure
(5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one structure
Common Name (5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one
CAS Number 127227-40-1 Molecular Weight 509.00300
Density 1.56g/cm3 Boiling Point 784.8ºC at 760mmHg
Molecular Formula C23H17ClN6O2S2 Melting Point N/A
MSDS N/A Flash Point 428.4ºC

 Names

Name S-[5-[4-(1H-indol-3-ylmethylidene)-2-methyl-5-oxoimidazol-1-yl]-1,3,4-thiadiazol-2-yl] 2-(4-chloroanilino)ethanethioate

 Chemical & Physical Properties

Density 1.56g/cm3
Boiling Point 784.8ºC at 760mmHg
Molecular Formula C23H17ClN6O2S2
Molecular Weight 509.00300
Flash Point 428.4ºC
Exact Mass 508.05400
PSA 156.88000
LogP 4.78330
Vapour Pressure 1.37E-24mmHg at 25°C
Index of Refraction 1.779

 Synthetic Route

~80%

(5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one Structure

(5E)-3-[5-[2-[(...

CAS#:127227-40-1

Literature: Shrimali; Kalsi; Sah; Dixit; Nath; Barthwal Indian Journal of Chemistry - Section B Organic Chemistry Including Medicinal Chemistry, 1990 , vol. 29, # 1 p. 85 - 87

~%

(5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one Structure

(5E)-3-[5-[2-[(...

CAS#:127227-40-1

Literature: Shrimali; Kalsi; Sah; Dixit; Nath; Barthwal Indian Journal of Chemistry - Section B Organic Chemistry Including Medicinal Chemistry, 1990 , vol. 29, # 1 p. 85 - 87

~%

(5E)-3-[5-[2-[(4-chlorophenyl)amino]acetyl]sulfanyl-1,3,4-thiadiazol-2-yl]-5-(1H-indol-3-ylmethylidene)-2-methyl-imidazol-4-one Structure

(5E)-3-[5-[2-[(...

CAS#:127227-40-1

Literature: Shrimali; Kalsi; Sah; Dixit; Nath; Barthwal Indian Journal of Chemistry - Section B Organic Chemistry Including Medicinal Chemistry, 1990 , vol. 29, # 1 p. 85 - 87

 Precursor & DownStream

Precursor  2

DownStream  0