5-(4-chlorophenyl)-1,3-dimethyl-6-[2-(methylamino)-5-nitrophenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione

Chemical Structure Depiction of
5-(4-chlorophenyl)-1,3-dimethyl-6-[2-(methylamino)-5-nitrophenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Available: 161 mg
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mg
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Compound characteristics

Compound ID: D077-0198
Compound Name: 5-(4-chlorophenyl)-1,3-dimethyl-6-[2-(methylamino)-5-nitrophenyl]-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Molecular Weight: 439.86
Molecular Formula: C21 H18 Cl N5 O4
Smiles: CNc1ccc(cc1n1cc2c(C(N(C)C(N2C)=O)=O)c1c1ccc(cc1)[Cl])[N+]([O-])=O
Stereo: ACHIRAL
logP: 3.8721
logD: 3.8721
logSw: -4.8038
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 75.827
InChI Key: BAPSMMFJTHIYBB-UHFFFAOYSA-N
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