N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-methylbenzene-1-sulfonyl)acetamide
Chemical Structure Depiction of
N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-methylbenzene-1-sulfonyl)acetamide
N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-methylbenzene-1-sulfonyl)acetamide
Compound characteristics
Compound ID: | G786-1299 |
Compound Name: | N-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]-2-(4-methylbenzene-1-sulfonyl)acetamide |
Molecular Weight: | 457.38 |
Molecular Formula: | C16 H13 Br N2 O3 S3 |
Smiles: | Cc1ccc(cc1)S(CC(Nc1nc(cs1)c1ccc(s1)[Br])=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6243 |
logD: | 4.6242 |
logSw: | -4.3067 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.946 |
InChI Key: | ROSJRTDPHIRSPW-UHFFFAOYSA-N |