4-chloro-N-(2-{[(4-iodophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[(4-iodophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
4-chloro-N-(2-{[(4-iodophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
Compound ID: | 8007-8422 |
Compound Name: | 4-chloro-N-(2-{[(4-iodophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
Molecular Weight: | 536.84 |
Molecular Formula: | C21 H14 Cl I N2 O S2 |
Smiles: | C(c1ccc(cc1)I)Sc1nc2ccc(cc2s1)NC(c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 7.2694 |
logD: | 7.2642 |
logSw: | -6.709 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 32.139 |
InChI Key: | CSLDHEFASLNROM-UHFFFAOYSA-N |