N-(3-chlorophenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide

Chemical Structure Depiction of
N-(3-chlorophenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide
Available: 2 mg
Amount:
mg
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Compound characteristics

Compound ID: M916-0101
Compound Name: N-(3-chlorophenyl)-3-(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purine-8-sulfonyl)propanamide
Molecular Weight: 439.88
Molecular Formula: C17 H18 Cl N5 O5 S
Smiles: CN1C(c2c(N(C)C1=O)n(C)c(n2)S(CCC(Nc1cccc(c1)[Cl])=O)(=O)=O)=O
Stereo: ACHIRAL
logP: 1.6143
logD: 1.6141
logSw: -2.8571
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 1
Polar surface area: 96.597
InChI Key: RLCOVBZCEDACKA-UHFFFAOYSA-N
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