5-[(3-methylphenyl)methyl]-4-oxo-N-(1-oxo-1-{[(pyridin-4-yl)methyl]amino}propan-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-[(3-methylphenyl)methyl]-4-oxo-N-(1-oxo-1-{[(pyridin-4-yl)methyl]amino}propan-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-[(3-methylphenyl)methyl]-4-oxo-N-(1-oxo-1-{[(pyridin-4-yl)methyl]amino}propan-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V023-8285 |
| Compound Name: | 5-[(3-methylphenyl)methyl]-4-oxo-N-(1-oxo-1-{[(pyridin-4-yl)methyl]amino}propan-2-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 460.54 |
| Molecular Formula: | C25 H28 N6 O3 |
| Salt: | not_available |
| Smiles: | CC(C(NCc1ccncc1)=O)NC(c1cc2C(N(CCCn2n1)Cc1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0343 |
| logD: | 1.0309 |
| logSw: | -1.6944 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.071 |
| InChI Key: | SBQSFLJLZFNNKC-SFHVURJKSA-N |