ethyl 4-amino-2-{[(4-methoxyphenyl)methyl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[(4-methoxyphenyl)methyl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[(4-methoxyphenyl)methyl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0060 |
| Compound Name: | ethyl 4-amino-2-{[(4-methoxyphenyl)methyl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 319.38 |
| Molecular Formula: | C15 H17 N3 O3 S |
| Smiles: | CCOC(c1cnc(nc1N)SCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5766 |
| logD: | 2.5766 |
| logSw: | -2.7613 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.776 |
| InChI Key: | HKQXOQSNRMHXEE-UHFFFAOYSA-N |