N-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-ethyl-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-ethyl-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-ethyl-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V022-5919 |
| Compound Name: | N-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-ethyl-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 501.63 |
| Molecular Formula: | C29 H35 N5 O3 |
| Salt: | not_available |
| Smiles: | CCN(CCC(N(C)Cc1ccccc1)=O)C(c1cc2C(N(CCCn2n1)Cc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2127 |
| logD: | 3.2127 |
| logSw: | -3.1871 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.19 |
| InChI Key: | QPGKPASWSVCLOI-UHFFFAOYSA-N |