N-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methyl-N-[2-(4-methylphenyl)-2-oxoethyl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methyl-N-[2-(4-methylphenyl)-2-oxoethyl]benzene-1-sulfonamide
N-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methyl-N-[2-(4-methylphenyl)-2-oxoethyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | D513-3668 |
| Compound Name: | N-(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methyl-N-[2-(4-methylphenyl)-2-oxoethyl]benzene-1-sulfonamide |
| Molecular Weight: | 483.98 |
| Molecular Formula: | C23 H22 Cl N5 O3 S |
| Smiles: | Cc1ccc(cc1)C(CN(c1nc2nc(C)c(c(C)n2n1)[Cl])S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3572 |
| logD: | 4.3558 |
| logSw: | -4.6492 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.104 |
| InChI Key: | IBTAYCKCLBUZIJ-UHFFFAOYSA-N |