N-(2-{[2-(4-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-phenoxyacetamide
Chemical Structure Depiction of
N-(2-{[2-(4-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-phenoxyacetamide
N-(2-{[2-(4-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-phenoxyacetamide
Compound characteristics
| Compound ID: | D336-2369 |
| Compound Name: | N-(2-{[2-(4-chloroanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-phenoxyacetamide |
| Molecular Weight: | 483.99 |
| Molecular Formula: | C23 H18 Cl N3 O3 S2 |
| Smiles: | C(C(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccc(cc1)[Cl])=O)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7401 |
| logD: | 5.74 |
| logSw: | -6.0191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.575 |
| InChI Key: | JNLOABDTZICMHJ-UHFFFAOYSA-N |