N-[(3-methoxyphenyl)methyl]-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-[(3-methoxyphenyl)methyl]-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0631 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 465.6 |
| Molecular Formula: | C30 H31 N3 O2 |
| Smiles: | CC(C)c1ccc(cc1)C1c2cccn2c2ccccc2CN1C(NCc1cccc(c1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9585 |
| logD: | 6.9585 |
| logSw: | -5.6495 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.437 |
| InChI Key: | UZAVMIRABNPAOM-GDLZYMKVSA-N |