7-(3,4-dimethoxyphenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
7-(3,4-dimethoxyphenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(3,4-dimethoxyphenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G922-0843 |
| Compound Name: | 7-(3,4-dimethoxyphenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 541.67 |
| Molecular Formula: | C30 H31 N5 O3 S |
| Smiles: | CC1=C(C(c2ccc(c(c2)OC)OC)n2c(N1)nc(n2)SCc1cc(C)ccc1C)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2628 |
| logD: | 6.2623 |
| logSw: | -5.3945 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.852 |
| InChI Key: | AGPYUBQDAOUXEJ-MHZLTWQESA-N |