2-[(4-methylphenyl)methyl]-1-(3-nitrophenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Chemical Structure Depiction of
2-[(4-methylphenyl)methyl]-1-(3-nitrophenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
2-[(4-methylphenyl)methyl]-1-(3-nitrophenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine
Compound characteristics
| Compound ID: | V022-8207 |
| Compound Name: | 2-[(4-methylphenyl)methyl]-1-(3-nitrophenyl)-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C22 H23 N3 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(CN2CCCn3cccc3C2c2cccc(c2)[N+]([O-])=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8077 |
| logD: | 4.795 |
| logSw: | -4.6257 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.323 |
| InChI Key: | VRGUGJYHPKPZCE-JOCHJYFZSA-N |