N-[(2-chloro-6-fluorophenyl)methyl]-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2-chloro-6-fluorophenyl)methyl]-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methylbenzene-1-sulfonamide
N-[(2-chloro-6-fluorophenyl)methyl]-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D513-3554 |
| Compound Name: | N-[(2-chloro-6-fluorophenyl)methyl]-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 459.93 |
| Molecular Formula: | C21 H19 Cl F N5 O2 S |
| Smiles: | Cc1ccc(cc1)S(N(Cc1c(cccc1[Cl])F)c1nc2nc(C)cc(C)n2n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2635 |
| logD: | 4.2634 |
| logSw: | -4.4604 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.31 |
| InChI Key: | HOWLLGUOENAWGK-UHFFFAOYSA-N |