methyl N-(4-chlorobenzene-1-sulfonyl)-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)glycinate
Chemical Structure Depiction of
methyl N-(4-chlorobenzene-1-sulfonyl)-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)glycinate
methyl N-(4-chlorobenzene-1-sulfonyl)-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)glycinate
Compound characteristics
| Compound ID: | D513-3577 |
| Compound Name: | methyl N-(4-chlorobenzene-1-sulfonyl)-N-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)glycinate |
| Molecular Weight: | 409.85 |
| Molecular Formula: | C16 H16 Cl N5 O4 S |
| Smiles: | Cc1cc(C)n2c(n1)nc(n2)N(CC(=O)OC)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8773 |
| logD: | 1.8773 |
| logSw: | -2.9282 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.161 |
| InChI Key: | YFTBLNLISVJSCI-UHFFFAOYSA-N |