7-(4-ethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
7-(4-ethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(4-ethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G922-0165 |
| Compound Name: | 7-(4-ethylphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 511.65 |
| Molecular Formula: | C29 H29 N5 O2 S |
| Smiles: | CCc1ccc(cc1)C1C(=C(C)Nc2nc(nn12)SCc1cccc(c1)OC)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3587 |
| logD: | 6.3582 |
| logSw: | -5.5154 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.134 |
| InChI Key: | AYUMVOREUYDWKQ-SANMLTNESA-N |