N-{3-[(butan-2-yl)amino]-3-oxopropyl}-N-ethyl-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-[(butan-2-yl)amino]-3-oxopropyl}-N-ethyl-5-[(2-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-{3-[(butan-2-yl)amino]-3-oxopropyl}-N-ethyl-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: | V018-4317 |
| Compound Name: | N-{3-[(butan-2-yl)amino]-3-oxopropyl}-N-ethyl-5-[(2-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C25 H35 N5 O3 |
| Salt: | not_available |
| Smiles: | CCC(C)NC(CCN(CC)C(c1cc2C(N(CCCn2n1)Cc1ccccc1C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7908 |
| logD: | 2.7908 |
| logSw: | -3.0335 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.48 |
| InChI Key: | JAOZMHOUHIDTNC-IBGZPJMESA-N |