N-(5-{4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,4-diazepane-1-sulfonyl}-4-methyl-1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(5-{4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,4-diazepane-1-sulfonyl}-4-methyl-1,3-thiazol-2-yl)acetamide
N-(5-{4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,4-diazepane-1-sulfonyl}-4-methyl-1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | V003-0695 |
| Compound Name: | N-(5-{4-[6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-1,4-diazepane-1-sulfonyl}-4-methyl-1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 542.64 |
| Molecular Formula: | C23 H26 N8 O4 S2 |
| Salt: | not_available |
| Smiles: | CC(Nc1nc(C)c(s1)S(N1CCCN(CC1)c1c(cnc2ncnn12)c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7169 |
| logD: | 2.4131 |
| logSw: | -3.3404 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.527 |
| InChI Key: | RLOGDHZAIRAASC-UHFFFAOYSA-N |