1-(4-{[abieta-8(14),9(11),12-trien-18-yl]amino}-3-nitrophenyl)-3-phenylpyrrolidine-2,5-dione
Chemical Structure Depiction of
1-(4-{[abieta-8(14),9(11),12-trien-18-yl]amino}-3-nitrophenyl)-3-phenylpyrrolidine-2,5-dione
1-(4-{[abieta-8(14),9(11),12-trien-18-yl]amino}-3-nitrophenyl)-3-phenylpyrrolidine-2,5-dione
Compound characteristics
Compound ID: | K807-2986 |
Compound Name: | 1-(4-{[abieta-8(14),9(11),12-trien-18-yl]amino}-3-nitrophenyl)-3-phenylpyrrolidine-2,5-dione |
Molecular Weight: | 579.74 |
Molecular Formula: | C36 H41 N3 O4 |
Smiles: | CC(C)c1ccc2c(CCC3C(C)(CCCC23C)CNc2ccc(cc2[N+]([O-])=O)N2C(CC(C2=O)c2ccccc2)=O)c1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 7.539 |
logD: | 7.539 |
logSw: | -5.7771 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.616 |
InChI Key: | CFTRUGIZQGOWFR-UHFFFAOYSA-N |