2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G922-0242 |
| Compound Name: | 2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-7-(pyridin-3-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 498.61 |
| Molecular Formula: | C27 H26 N6 O2 S |
| Smiles: | CC1=C(C(c2cccnc2)n2c(N1)nc(n2)SCc1cccc(c1)OC)C(Nc1ccccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4491 |
| logD: | 4.4448 |
| logSw: | -4.2236 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.954 |
| InChI Key: | ANMFXCDSYRUEDX-DEOSSOPVSA-N |