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ethyl 7-(4-chlorophenyl)-5-methyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Chemical Structure Depiction of
ethyl 7-(4-chlorophenyl)-5-methyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Available: 53 mg
Amount:
mg
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$83.09
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Compound characteristics

Compound ID: C202-1439
Compound Name: ethyl 7-(4-chlorophenyl)-5-methyl-2-{[(4-nitrophenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Molecular Weight: 485.95
Molecular Formula: C22 H20 Cl N5 O4 S
Smiles: CCOC(C1C(c2ccc(cc2)[Cl])n2c(NC=1C)nc(n2)SCc1ccc(cc1)[N+]([O-])=O)=O
Stereo: RACEMIC MIXTURE
logP: 5.1367
logD: 5.0357
logSw: -5.7648
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 1
Polar surface area: 89.635
InChI Key: JTEGASJDKOTMLC-IBGZPJMESA-N
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