7-(2-chlorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
7-(2-chlorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(2-chlorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | C202-2780 |
| Compound Name: | 7-(2-chlorophenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 536.03 |
| Molecular Formula: | C27 H23 Cl F N5 O2 S |
| Smiles: | CC1=C(C(c2ccccc2[Cl])n2c(N1)nc(n2)SCc1cccc(c1)F)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2151 |
| logD: | 6.2148 |
| logSw: | -6.0752 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.523 |
| InChI Key: | YNFGAZAIFCLBRF-DEOSSOPVSA-N |