5-(4-phenylsulfanylphenyl)-2,6-diazabicyclo[5.4.0]undeca-5,7,9,11-tetraene-3-thione

Modify Date: 2025-08-28 21:13:47

5-(4-phenylsulfanylphenyl)-2,6-diazabicyclo[5.4.0]undeca-5,7,9,11-tetraene-3-thione structure	Common Name	5-(4-phenylsulfanylphenyl)-2,6-diazabicyclo[5.4.0]undeca-5,7,9,11-tetraene-3-thione
	CAS Number	41054-49-3	Molecular Weight	360.49500
	Density	1.24g/cm3	Boiling Point	526.4ºC at 760 mmHg
	Molecular Formula	C₂₁H₁₆N₂S₂	Melting Point	N/A
	MSDS	N/A	Flash Point	272.1ºC

Name	4-(4-phenylsulfanylphenyl)-1,3-dihydro-1,5-benzodiazepine-2-thione
Synonym	More Synonyms

Density	1.24g/cm3
Boiling Point	526.4ºC at 760 mmHg
Molecular Formula	C₂₁H₁₆N₂S₂
Molecular Weight	360.49500
Flash Point	272.1ºC
Exact Mass	360.07500
PSA	81.78000
LogP	5.67520
Index of Refraction	1.688
InChIKey	NOKVZZHHQACBIN-UHFFFAOYSA-N
SMILES	S=C1CC(c2ccc(Sc3ccccc3)cc2)=Nc2ccccc2N1

HS Code	2933990090

3-oxo-3-[p-(phe...

CAS#:41054-41-5

o-Phenylenediamine

CAS#:95-54-5

5-(4-phenylsulf...

CAS#:41054-49-3

Literature: Recordati S.A. Chemical and Pharmaceutical Company Patent: US3933793 A1, 1976 ;

Precursor 2
CAS#:41054-41-5 3-oxo-3-[p-(phe... CAS#:95-54-5 o-Phenylenediamine
DownStream 0

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

EINECS 255-196-2

4,p-phenylthiophenyl-1,3-dihydro-2H-1,5-benzodiazepine-2-thione

Names