1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[(4-fluorophenyl)methyl]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-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | V022-5012 |
| Compound Name: | 1-(5-benzyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carbonyl)-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 503.58 |
| Molecular Formula: | C28 H30 F N5 O3 |
| Salt: | not_available |
| Smiles: | C1CN(Cc2ccccc2)C(c2cc(C(N3CCC(CC3)C(NCc3ccc(cc3)F)=O)=O)nn2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0423 |
| logD: | 2.0423 |
| logSw: | -2.6098 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.443 |
| InChI Key: | KUTXIQYOCFDBRZ-UHFFFAOYSA-N |