1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[2-(dimethylamino)ethyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[2-(dimethylamino)ethyl]piperidine-4-carboxamide
1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[2-(dimethylamino)ethyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V025-1160 |
| Compound Name: | 1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[2-(dimethylamino)ethyl]piperidine-4-carboxamide |
| Molecular Weight: | 466.58 |
| Molecular Formula: | C25 H34 N6 O3 |
| Salt: | not_available |
| Smiles: | CN(C)CCNC(C1CCN(CC1)C(c1cc2C(N(CCCn2n1)Cc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5891 |
| logD: | -1.0397 |
| logSw: | -1.9841 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.422 |
| InChI Key: | SHMIMMXHZJJFPD-UHFFFAOYSA-N |