5-[(4-methylphenyl)methyl]-4-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Chemical Structure Depiction of
5-[(4-methylphenyl)methyl]-4-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
5-[(4-methylphenyl)methyl]-4-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
Compound characteristics
| Compound ID: | G542-0502 |
| Compound Name: | 5-[(4-methylphenyl)methyl]-4-oxo-N-[(thiophen-2-yl)methyl]-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 394.49 |
| Molecular Formula: | C21 H22 N4 O2 S |
| Smiles: | Cc1ccc(CN2CCCn3c(cc(C(NCc4cccs4)=O)n3)C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8912 |
| logD: | 2.8912 |
| logSw: | -3.2518 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.813 |
| InChI Key: | XHZKSUGQWDTLAI-UHFFFAOYSA-N |