5-[(3-methylphenyl)methyl]-4-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-[(3-methylphenyl)methyl]-4-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-[(3-methylphenyl)methyl]-4-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-2596 |
| Compound Name: | 5-[(3-methylphenyl)methyl]-4-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 466.63 |
| Molecular Formula: | C26 H38 N6 O2 |
| Smiles: | CCCN1CCN(CCCNC(c2cc3C(N(CCCn3n2)Cc2cccc(C)c2)=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.0604 |
| logD: | 1.0956 |
| logSw: | -2.6285 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.409 |
| InChI Key: | LMUMQWJUSJYWQU-UHFFFAOYSA-N |