5-benzyl-N-cyclooctyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-benzyl-N-cyclooctyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-benzyl-N-cyclooctyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0085 |
| Compound Name: | 5-benzyl-N-cyclooctyl-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 394.52 |
| Molecular Formula: | C23 H30 N4 O2 |
| Smiles: | C1CCCC(CCC1)NC(c1cc2C(N(CCCn2n1)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7731 |
| logD: | 3.7731 |
| logSw: | -3.9115 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.851 |
| InChI Key: | WGATVDCXPWHOKF-UHFFFAOYSA-N |