N-{[4-(dimethylamino)phenyl]methyl}-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-{[4-(dimethylamino)phenyl]methyl}-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide
N-{[4-(dimethylamino)phenyl]methyl}-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: | G542-0621 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-5-[(4-methylphenyl)methyl]-4-oxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine-2-carboxamide |
| Molecular Weight: | 431.54 |
| Molecular Formula: | C25 H29 N5 O2 |
| Smiles: | Cc1ccc(CN2CCCn3c(cc(C(NCc4ccc(cc4)N(C)C)=O)n3)C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0062 |
| logD: | 2.9908 |
| logSw: | -3.1928 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.6 |
| InChI Key: | RWLMZHOGVZAPOR-UHFFFAOYSA-N |