5-[(3-methylphenyl)methyl]-4-oxo-N-[3-(pyrrolidin-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-(pyrrolidin-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-(pyrrolidin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-2582 |
| Compound Name: | 5-[(3-methylphenyl)methyl]-4-oxo-N-[3-(pyrrolidin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C23 H31 N5 O2 |
| Smiles: | Cc1cccc(CN2CCCn3c(cc(C(NCCCN4CCCC4)=O)n3)C2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.0775 |
| logD: | -0.955 |
| logSw: | -2.665 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.985 |
| InChI Key: | VZLDVIACVIXRFO-UHFFFAOYSA-N |