N-(5-chloro-2-methoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(5-chloro-2-methoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1022 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 449.96 |
| Molecular Formula: | C24 H20 Cl N3 O2 S |
| Smiles: | COc1ccc(cc1NC(N1Cc2ccccc2n2cccc2C1c1cccs1)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0336 |
| logD: | 6.0335 |
| logSw: | -6.0155 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.522 |
| InChI Key: | YSZAXVFTFMNFMY-QHCPKHFHSA-N |