4-methoxyphenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate
Chemical Structure Depiction of
4-methoxyphenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate
4-methoxyphenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D233-0109 |
| Compound Name: | 4-methoxyphenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate |
| Molecular Weight: | 400.88 |
| Molecular Formula: | C20 H17 Cl N2 O3 S |
| Smiles: | Cc1ccc(CSc2ncc(c(C(=O)Oc3ccc(cc3)OC)n2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0347 |
| logD: | 5.0347 |
| logSw: | -5.1636 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.474 |
| InChI Key: | SOZGZXHWYPVGSK-UHFFFAOYSA-N |