ethyl 4-amino-2-{[(4-bromophenyl)methyl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[(4-bromophenyl)methyl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[(4-bromophenyl)methyl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y020-0588 |
| Compound Name: | ethyl 4-amino-2-{[(4-bromophenyl)methyl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 368.25 |
| Molecular Formula: | C14 H14 Br N3 O2 S |
| Smiles: | CCOC(c1cnc(nc1N)SCc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4281 |
| logD: | 3.4281 |
| logSw: | -3.5792 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.232 |
| InChI Key: | GXIXTZJXNFJWOP-UHFFFAOYSA-N |