ethyl 4-amino-2-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate

Chemical Structure Depiction of
ethyl 4-amino-2-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
Available: 199 mg
Amount:
mg
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Compound characteristics

Compound ID: E726-0093
Compound Name: ethyl 4-amino-2-{[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
Molecular Weight: 429.27
Molecular Formula: C15 H14 Br F N4 O3 S
Smiles: CCOC(c1cnc(nc1N)SCC(Nc1ccc(cc1F)[Br])=O)=O
Stereo: ACHIRAL
logP: 2.9502
logD: 2.9424
logSw: -3.3988
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 3
Polar surface area: 81.684
InChI Key: GAQWSTXXPMYNDB-UHFFFAOYSA-N
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