N-[(4-methoxyphenyl)methyl]-2-{[(3-methylphenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-{[(3-methylphenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide
N-[(4-methoxyphenyl)methyl]-2-{[(3-methylphenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D506-0037 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-{[(3-methylphenyl)methyl]sulfanyl}-5-(phenylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C27 H25 N3 O2 S2 |
| Smiles: | [H]N(Cc1ccc(cc1)OC)C(c1c(cnc(n1)SCc1cccc(C)c1)Sc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.364 |
| logD: | 6.364 |
| logSw: | -5.3558 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.238 |
| InChI Key: | YLTMVLULTAUVEF-UHFFFAOYSA-N |