2-chloro-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[4-(propan-2-yl)phenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
2-chloro-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[4-(propan-2-yl)phenyl]benzene-1-sulfonamide
2-chloro-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[4-(propan-2-yl)phenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | L299-0928 |
| Compound Name: | 2-chloro-5-(2-methyl-5,8-dioxo-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,3]diazepin-3-yl)-N-[4-(propan-2-yl)phenyl]benzene-1-sulfonamide |
| Molecular Weight: | 486.98 |
| Molecular Formula: | C23 H23 Cl N4 O4 S |
| Smiles: | CC(C)c1ccc(cc1)NS(c1cc(ccc1[Cl])c1c(C)nn2C(CCC(Nc12)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.237 |
| logD: | 2.9519 |
| logSw: | -4.1587 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.063 |
| InChI Key: | PXRDPQVUMINHPT-UHFFFAOYSA-N |