N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,4-dichlorobenzamide
Chemical Structure Depiction of
N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,4-dichlorobenzamide
N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,4-dichlorobenzamide
Compound characteristics
Compound ID: | 8007-5572 |
Compound Name: | N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2,4-dichlorobenzamide |
Molecular Weight: | 530.45 |
Molecular Formula: | C24 H17 Cl2 N3 O3 S2 |
Smiles: | CC(c1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(c1ccc(cc1[Cl])[Cl])=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.8572 |
logD: | 5.8138 |
logSw: | -5.9401 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 69.116 |
InChI Key: | BJEJMFBOBDGHBV-UHFFFAOYSA-N |