N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | V023-5546 |
| Compound Name: | N-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 466.54 |
| Molecular Formula: | C24 H30 N6 O4 |
| Smiles: | CC(N1CCN(CC1)C(CNC(c1cc2C(N(CCCn2n1)Cc1ccc(C)cc1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4782 |
| logD: | 0.4781 |
| logSw: | -2.0305 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.383 |
| InChI Key: | BLCUNPWJORAZNB-UHFFFAOYSA-N |