2-{[(3-methylphenyl)methyl]sulfanyl}-N-phenyl-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-{[(3-methylphenyl)methyl]sulfanyl}-N-phenyl-5-(phenylsulfanyl)pyrimidine-4-carboxamide
2-{[(3-methylphenyl)methyl]sulfanyl}-N-phenyl-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D506-0029 |
| Compound Name: | 2-{[(3-methylphenyl)methyl]sulfanyl}-N-phenyl-5-(phenylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C25 H21 N3 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1cccc(C)c1)Sc1ccccc1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5986 |
| logD: | 6.5986 |
| logSw: | -5.4444 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.372 |
| InChI Key: | UUWZZGAKTVYDAG-UHFFFAOYSA-N |