N-[(4-ethylphenyl)methyl]-4-methyl-2-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-4-methyl-2-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,3-thiazole-5-carboxamide
N-[(4-ethylphenyl)methyl]-4-methyl-2-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | L102-0746 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-4-methyl-2-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 463.62 |
| Molecular Formula: | C24 H25 N5 O S2 |
| Smiles: | CCc1ccc(CNC(c2c(C)nc(c3c(C)n(c4cccc(c4)SC)nn3)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1464 |
| logD: | 5.1463 |
| logSw: | -4.9922 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.806 |
| InChI Key: | YVTNHMUKSUMBRJ-UHFFFAOYSA-N |