4-(2-cyano-3-{[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]amino}-3-oxo-1-propenyl)-2-methoxyphenyl 3-methylbenzoate

Chemical Structure Depiction of
4-(2-cyano-3-{[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]amino}-3-oxo-1-propenyl)-2-methoxyphenyl 3-methylbenzoate
Available: 136 mg
Amount:
mg
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Compound characteristics

Compound ID: C355-1298
Compound Name: 4-(2-cyano-3-{[3-(isopropylsulfonyl)-1,2,4-thiadiazol-5-yl]amino}-3-oxo-1-propenyl)-2-methoxyphenyl 3-methylbenzoate
Molecular Weight: 526.59
Molecular Formula: C24 H22 N4 O6 S2
Smiles: CC(C)S(c1nc(NC(C(=C/c2ccc(c(c2)OC)OC(c2cccc(C)c2)=O)\C#N)=O)sn1)(=O)=O
Stereo: ACHIRAL
logP: 4.26
logD: 1.91
logSw: -5.16
Hydrogen bond acceptors count: 13
Hydrogen bond donors count: 1
Polar surface area: 236.65
InChI Key: BOQNMVORTKWJHT-UHFFFAOYSA-N
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