methyl 2-[(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carbonyl)amino]benzoate

Chemical Structure Depiction of
methyl 2-[(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carbonyl)amino]benzoate
Available: 239 mg
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mg
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Compound characteristics

Compound ID: D233-0081
Compound Name: methyl 2-[(5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carbonyl)amino]benzoate
Molecular Weight: 427.91
Molecular Formula: C21 H18 Cl N3 O3 S
Smiles: [H]N(C(c1c(cnc(n1)SCc1ccc(C)cc1)[Cl])=O)c1ccccc1C(=O)OC
Stereo: ACHIRAL
logP: 4.8903
logD: 3.5614
logSw: -4.8837
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 62.119
InChI Key: QPMQETNPZHEZRS-UHFFFAOYSA-N
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