N-(2-methoxy-5-methylphenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(2-methoxy-5-methylphenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-0882 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-4-methyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C22 H23 N3 O2 |
| Smiles: | CC1c2cccn2c2ccccc2CN1C(Nc1cc(C)ccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5098 |
| logD: | 4.5098 |
| logSw: | -4.2959 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.366 |
| InChI Key: | KBHWJWWASLVNQH-INIZCTEOSA-N |