2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-0462 |
| Compound Name: | 2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[(4-methylphenyl)methyl]benzene-1-sulfonamide |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C23 H24 N4 O4 S |
| Smiles: | Cc1ccc(CNS(c2cc(ccc2C)c2c(C)nn3C(CCC(Nc23)=O)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.2815 |
| logD: | 1.9964 |
| logSw: | -2.9669 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.171 |
| InChI Key: | DCDVEXRYYFUABK-UHFFFAOYSA-N |