N-(2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
N-(2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8009-9301 |
| Compound Name: | N-(2-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 575.73 |
| Molecular Formula: | C27 H25 N7 O2 S3 |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CSc1nc2ccc(cc2s1)NC(CSc1nnnn1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4056 |
| logD: | 5.4056 |
| logSw: | -5.3023 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.602 |
| InChI Key: | SVUFRMSJTKAWGM-UHFFFAOYSA-N |