N-{3-[benzyl(methyl)amino]-3-oxopropyl}-5-[(2-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}-5-[(2-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}-5-[(2-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V016-6161 |
| Compound Name: | N-{3-[benzyl(methyl)amino]-3-oxopropyl}-5-[(2-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C27 H31 N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1CN1CCCn2c(cc(C(NCCC(N(C)Cc3ccccc3)=O)=O)n2)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.021 |
| logD: | 3.021 |
| logSw: | -3.2885 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.531 |
| InChI Key: | ZPQJRMPHNPTKFW-UHFFFAOYSA-N |