N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8009-8354 |
| Compound Name: | N-(2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C19 H23 N7 O2 S3 |
| Smiles: | Cn1c(nnn1)SCC(Nc1ccc2c(c1)sc(n2)SCC(NC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1687 |
| logD: | 3.1687 |
| logSw: | -3.3784 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.466 |
| InChI Key: | CEIMQHIOJZFCKZ-UHFFFAOYSA-N |