ethyl 4-amino-2-{[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate

Chemical Structure Depiction of
ethyl 4-amino-2-{[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
Available: 121 mg
Amount:
mg
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Compound characteristics

Compound ID: E726-0089
Compound Name: ethyl 4-amino-2-{[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
Molecular Weight: 380.85
Molecular Formula: C16 H17 Cl N4 O3 S
Smiles: CCOC(c1cnc(nc1N)SCC(Nc1cccc(c1C)[Cl])=O)=O
Stereo: ACHIRAL
logP: 3.077
logD: 3.0768
logSw: -3.4644
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 3
Polar surface area: 81.684
InChI Key: BUHXLWIZFNPXDU-UHFFFAOYSA-N
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