N-[2-(4-chlorophenyl)ethyl]-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-(4-chlorophenyl)ethyl]-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-(4-chlorophenyl)ethyl]-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: | L299-0430 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-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: | 486.98 |
| Molecular Formula: | C23 H23 Cl N4 O4 S |
| Smiles: | Cc1ccc(cc1S(NCCc1ccc(cc1)[Cl])(=O)=O)c1c(C)nn2C(CCC(Nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6187 |
| logD: | 2.3336 |
| logSw: | -3.865 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.013 |
| InChI Key: | CIOSWBRTAKUNOY-UHFFFAOYSA-N |