2-bromo-6-{2-[(4-chlorophenyl)sulfanyl]acetamido}-3-methylbenzoic acid
Chemical Structure Depiction of
2-bromo-6-{2-[(4-chlorophenyl)sulfanyl]acetamido}-3-methylbenzoic acid
2-bromo-6-{2-[(4-chlorophenyl)sulfanyl]acetamido}-3-methylbenzoic acid
Compound characteristics
| Compound ID: | 8015-5011 |
| Compound Name: | 2-bromo-6-{2-[(4-chlorophenyl)sulfanyl]acetamido}-3-methylbenzoic acid |
| Molecular Weight: | 414.7 |
| Molecular Formula: | C16 H13 Br Cl N O3 S |
| Smiles: | Cc1ccc(c(C(O)=O)c1[Br])NC(CSc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.56 |
| logD: | -0.3116 |
| logSw: | -4.6777 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.826 |
| InChI Key: | UYHJAEHPOPFWOS-UHFFFAOYSA-N |