2-[(2-chloro-5-nitrophenyl)methyl]-1-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
2-[(2-chloro-5-nitrophenyl)methyl]-1-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
2-[(2-chloro-5-nitrophenyl)methyl]-1-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V005-7562 |
| Compound Name: | 2-[(2-chloro-5-nitrophenyl)methyl]-1-(3,4-dimethylphenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 409.91 |
| Molecular Formula: | C23 H24 Cl N3 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)C1c2cccn2CCCN1Cc1cc(ccc1[Cl])[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0687 |
| logD: | 6.0614 |
| logSw: | -6.3227 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.323 |
| InChI Key: | GHMIUNNNAHCMGS-HSZRJFAPSA-N |