4-(4-methylbenzene-1-sulfonyl)-N-[(pyridin-3-yl)methyl]-2-(thiophen-2-yl)-1,3-oxazol-5-amine
Chemical Structure Depiction of
4-(4-methylbenzene-1-sulfonyl)-N-[(pyridin-3-yl)methyl]-2-(thiophen-2-yl)-1,3-oxazol-5-amine
4-(4-methylbenzene-1-sulfonyl)-N-[(pyridin-3-yl)methyl]-2-(thiophen-2-yl)-1,3-oxazol-5-amine
Compound characteristics
Compound ID: | D072-1276 |
Compound Name: | 4-(4-methylbenzene-1-sulfonyl)-N-[(pyridin-3-yl)methyl]-2-(thiophen-2-yl)-1,3-oxazol-5-amine |
Molecular Weight: | 411.5 |
Molecular Formula: | C20 H17 N3 O3 S2 |
Smiles: | Cc1ccc(cc1)S(c1c(NCc2cccnc2)oc(c2cccs2)n1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.676 |
logD: | 3.6614 |
logSw: | -3.5812 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.538 |
InChI Key: | PRGFTBVAQIWADY-UHFFFAOYSA-N |