3-methyl-N-[(4-methylphenyl)methyl]-6-[4-(methylsulfanyl)phenyl]-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Chemical Structure Depiction of
3-methyl-N-[(4-methylphenyl)methyl]-6-[4-(methylsulfanyl)phenyl]-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
3-methyl-N-[(4-methylphenyl)methyl]-6-[4-(methylsulfanyl)phenyl]-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G544-0552 |
| Compound Name: | 3-methyl-N-[(4-methylphenyl)methyl]-6-[4-(methylsulfanyl)phenyl]-1-phenyl-1,4-dihydropyrazolo[4,3-f]pyrrolo[1,2-a][1,4]diazepine-5(6H)-carboxamide |
| Molecular Weight: | 533.7 |
| Molecular Formula: | C32 H31 N5 O S |
| Smiles: | Cc1ccc(CNC(N2Cc3c(C)nn(c4ccccc4)c3n3cccc3C2c2ccc(cc2)SC)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9476 |
| logD: | 6.9476 |
| logSw: | -5.7503 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.318 |
| InChI Key: | IWQIRBSIRJEMCR-SSEXGKCCSA-N |