4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}-N-(6-methyl-1,3-benzothiazol-2-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}-N-(6-methyl-1,3-benzothiazol-2-yl)cyclohexane-1-carboxamide
4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}-N-(6-methyl-1,3-benzothiazol-2-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C274-3660 |
| Compound Name: | 4-{[(5-bromothiophene-2-sulfonyl)amino]methyl}-N-(6-methyl-1,3-benzothiazol-2-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 528.51 |
| Molecular Formula: | C20 H22 Br N3 O3 S3 |
| Smiles: | Cc1ccc2c(c1)sc(NC(C1CCC(CC1)CNS(c1ccc(s1)[Br])(=O)=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.8779 |
| logD: | 5.8777 |
| logSw: | -5.4024 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.06 |
| InChI Key: | JNGPUZFFKGLIHW-UHFFFAOYSA-N |