2-chloro-5-(5-{[1-(naphthalen-2-yl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}furan-2-yl)benzoic acid

Chemical Structure Depiction of
2-chloro-5-(5-{[1-(naphthalen-2-yl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}furan-2-yl)benzoic acid
Available: 3 mg
Amount:
mg
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Compound characteristics

Compound ID: 3269-0127
Compound Name: 2-chloro-5-(5-{[1-(naphthalen-2-yl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl}furan-2-yl)benzoic acid
Molecular Weight: 502.93
Molecular Formula: C26 H15 Cl N2 O5 S
Smiles: C(=C1/C(NC(N(C1=O)c1ccc2ccccc2c1)=S)=O)/c1ccc(c2ccc(c(c2)C(O)=O)[Cl])o1
Stereo: ACHIRAL
logP: 5.4664
logD: 1.0361
logSw: -5.8125
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 75.935
InChI Key: TVQRFFWRYUSPQL-UHFFFAOYSA-N
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