N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8009-9033 |
| Compound Name: | N-(2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 536.11 |
| Molecular Formula: | C21 H18 Cl N5 O2 S4 |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1nc2ccc(cc2s1)NC(CSc1nnc(C)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5858 |
| logD: | 5.5856 |
| logSw: | -5.9096 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.747 |
| InChI Key: | OAXZVNDMKCISQF-UHFFFAOYSA-N |