2-{[(2-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-{[(2-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
2-{[(2-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | C202-3130 |
| Compound Name: | 2-{[(2-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(4-methylphenyl)-7-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 497.62 |
| Molecular Formula: | C28 H27 N5 O2 S |
| Smiles: | CC1=C(C(c2ccccc2)n2c(N1)nc(n2)SCc1ccccc1OC)C(Nc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0962 |
| logD: | 6.0956 |
| logSw: | -5.5243 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.221 |
| InChI Key: | BLXHRZGESFVKNL-VWLOTQADSA-N |