2-(4-Chlorophenyl)-4-(methylthio)-3H-1,5-benzodiazepine
2-(4-chlorophenyl)-4-methylsulfanyl-3H-1,5-benzodiazepine
Also Known As: NCI60_015316|2-(4-Chlorophenyl)-4-(methylthio)-3H-1,5-benzodiazepine|2-(4-chlorophenyl)-4-methylsulfanyl-3H-1,5-benzodiazepine|2-methylthio-4-(p-chlorophenyl)-3H-1,5-benzodiazepine|4-(4-Chlorophenyl)-3H-1,5-benzodiazepin-2-yl methyl sulfide
| Molecular Formula | C16H13ClN2S |
|---|---|
| Molecular Weight | 300.0488 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 50.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.0488 |
| Monoisotopic Mass | 300.0488 |
| Heavy Atoms | 20 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 67259-53-4 |
|---|---|
| SMILES | CSC1=NC2=CC=CC=C2N=C(C1)C3=CC=C(C=C3)Cl |
| InChIKey | BNIMMKNKRKZBSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Chlorophenyl)-4-(methylthio)-3H-1,5-benzodiazepine (CAS 67259-53-4), with molecular formula C16H13ClN2S and molecular weight 300.0488 g/mol. IUPAC: 2-(4-chlorophenyl)-4-methylsulfanyl-3H-1,5-benzodiazepine.
2-(4-Chlorophenyl)-4-(methylthio)-3H-1,5-benzodiazepine is a custom synthesis product. We offer services from milligram to kilogram scale.
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