ethyl 4-amino-2-({1-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-oxopropan-2-yl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({1-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-oxopropan-2-yl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({1-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-oxopropan-2-yl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0393 |
| Compound Name: | ethyl 4-amino-2-({1-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-1-oxopropan-2-yl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C18 H20 N4 O5 S |
| Smiles: | CCOC(c1cnc(nc1N)SC(C)C(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6743 |
| logD: | 1.6743 |
| logSw: | -2.6931 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.418 |
| InChI Key: | KQSVASGJTQCCPK-JTQLQIEISA-N |