N-[3-(4-ethylpiperazin-1-yl)propyl]-5-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-[3-(4-ethylpiperazin-1-yl)propyl]-5-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-[3-(4-ethylpiperazin-1-yl)propyl]-5-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0928 |
| Compound Name: | N-[3-(4-ethylpiperazin-1-yl)propyl]-5-[(4-fluorophenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C24 H33 F N6 O2 |
| Smiles: | CCN1CCN(CCCNC(c2cc3C(N(CCCn3n2)Cc2ccc(cc2)F)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 0.9754 |
| logD: | 0.0272 |
| logSw: | -2.2998 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.156 |
| InChI Key: | VILYTZKFHZPTEZ-UHFFFAOYSA-N |