2-chloro-4-[2-({5-[(2,4-dichlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoic acid
Chemical Structure Depiction of
2-chloro-4-[2-({5-[(2,4-dichlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoic acid
2-chloro-4-[2-({5-[(2,4-dichlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoic acid
Compound characteristics
| Compound ID: | 8017-9712 |
| Compound Name: | 2-chloro-4-[2-({5-[(2,4-dichlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoic acid |
| Molecular Weight: | 504.8 |
| Molecular Formula: | C18 H12 Cl3 N3 O4 S2 |
| Smiles: | C(c1nnc(SCC(Nc2ccc(C(O)=O)c(c2)[Cl])=O)s1)Oc1ccc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1149 |
| logD: | 1.8035 |
| logSw: | -5.1472 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.199 |
| InChI Key: | RQQRIYPLZDAVNN-UHFFFAOYSA-N |