N-(2-chloro-4-methylphenyl)-2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide
N-(2-chloro-4-methylphenyl)-2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-0498 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-methyl-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)benzene-1-sulfonamide |
| Molecular Weight: | 472.95 |
| Molecular Formula: | C22 H21 Cl N4 O4 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NS(c1cc(ccc1C)c1c(C)nn2C(CCC(Nc12)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.858 |
| logD: | 0.9412 |
| logSw: | -3.8283 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.365 |
| InChI Key: | JYLCVYVQQJFSNP-UHFFFAOYSA-N |