ethyl 4-amino-2-({2-[methyl(phenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({2-[methyl(phenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({2-[methyl(phenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0046 |
| Compound Name: | ethyl 4-amino-2-({2-[methyl(phenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 346.41 |
| Molecular Formula: | C16 H18 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1N)SCC(N(C)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7113 |
| logD: | 1.7113 |
| logSw: | -2.4969 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.345 |
| InChI Key: | RROGECMKXOOOEU-UHFFFAOYSA-N |