N-(4-fluorophenyl)-5-{2-[methyl(phenyl)amino]-2-oxoethyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-{2-[methyl(phenyl)amino]-2-oxoethyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-(4-fluorophenyl)-5-{2-[methyl(phenyl)amino]-2-oxoethyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | S367-0496 |
| Compound Name: | N-(4-fluorophenyl)-5-{2-[methyl(phenyl)amino]-2-oxoethyl}-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 435.46 |
| Molecular Formula: | C23 H22 F N5 O3 |
| Smiles: | CN(C(CN1CCCn2c(cc(C(Nc3ccc(cc3)F)=O)n2)C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.7013 |
| logD: | 1.694 |
| logSw: | -2.4591 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.586 |
| InChI Key: | MAPCRDNQLGDFLE-UHFFFAOYSA-N |