4-{3-(furan-2-yl)-11-[4-(methoxycarbonyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoic acid

Chemical Structure Depiction of
4-{3-(furan-2-yl)-11-[4-(methoxycarbonyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoic acid
Available: 71 mg
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mg
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Compound characteristics

Compound ID: 4780-0133
Compound Name: 4-{3-(furan-2-yl)-11-[4-(methoxycarbonyl)phenyl]-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-4-oxobutanoic acid
Molecular Weight: 514.53
Molecular Formula: C29 H26 N2 O7
Smiles: COC(c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccco2)Nc2ccccc2N1C(CCC(O)=O)=O)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.8557
logD: 0.9063
logSw: -4.0778
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 2
Polar surface area: 96.773
InChI Key: KMASJEGKTCPBQQ-UHFFFAOYSA-N
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