ethyl 2-{2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-{2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
Compound ID: | D487-0387 |
Compound Name: | ethyl 2-{2-[(3-hydroxy-1,2,4-triazin-5-yl)sulfanyl]acetamido}-4-methyl-1,3-thiazole-5-carboxylate |
Molecular Weight: | 355.39 |
Molecular Formula: | C12 H13 N5 O4 S2 |
Smiles: | CCOC(c1c(C)nc(NC(CSc2cnnc(n2)O)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 0.9378 |
logD: | 0.8875 |
logSw: | -2.0255 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 103.383 |
InChI Key: | OVFOGKMKJCRQAA-UHFFFAOYSA-N |