2-{[4-methyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[4-methyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[4-methyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-6027 |
| Compound Name: | 2-{[4-methyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 322.45 |
| Molecular Formula: | C14 H18 N4 O S2 |
| Smiles: | CC1CCc2c(csc2C1)c1nnc(n1C)SCC(N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2757 |
| logD: | 2.2756 |
| logSw: | -2.348 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.649 |
| InChI Key: | FNHLGUAVCNRQDJ-MRVPVSSYSA-N |