N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y020-0550 |
| Compound Name: | N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 309.41 |
| Molecular Formula: | C12 H15 N5 O S2 |
| Smiles: | CC1CCc2c(C1)sc(NC(CSc1nnc[nH]1)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8107 |
| logD: | 1.4562 |
| logSw: | -2.3263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.009 |
| InChI Key: | FLHOKHBDGYYWEZ-ZETCQYMHSA-N |