ethyl 4-(benzylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(benzylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylate
ethyl 4-(benzylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | Y010-0319 |
| Compound Name: | ethyl 4-(benzylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 303.38 |
| Molecular Formula: | C15 H17 N3 O2 S |
| Smiles: | CCOC(c1cnc(nc1NCc1ccccc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3233 |
| logD: | 3.3233 |
| logSw: | -3.4233 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.681 |
| InChI Key: | JUVBOQHAEZDXDP-UHFFFAOYSA-N |