ethyl 4-methyl-2-[2-(phenylmethanesulfonyl)acetamido]-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-methyl-2-[2-(phenylmethanesulfonyl)acetamido]-1,3-thiazole-5-carboxylate
ethyl 4-methyl-2-[2-(phenylmethanesulfonyl)acetamido]-1,3-thiazole-5-carboxylate
Compound characteristics
Compound ID: | Y031-1582 |
Compound Name: | ethyl 4-methyl-2-[2-(phenylmethanesulfonyl)acetamido]-1,3-thiazole-5-carboxylate |
Molecular Weight: | 382.46 |
Molecular Formula: | C16 H18 N2 O5 S2 |
Smiles: | CCOC(c1c(C)nc(NC(CS(Cc2ccccc2)(=O)=O)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.0247 |
logD: | 1.7324 |
logSw: | -2.5379 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 82.793 |
InChI Key: | NPPTZWCGPAXPCN-UHFFFAOYSA-N |