4-[11-(4-methoxyphenyl)-8-methyl-1-oxo-3-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[11-(4-methoxyphenyl)-8-methyl-1-oxo-3-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
4-[11-(4-methoxyphenyl)-8-methyl-1-oxo-3-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 5236-0280 |
| Compound Name: | 4-[11-(4-methoxyphenyl)-8-methyl-1-oxo-3-phenyl-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-4-oxobutanoic acid |
| Molecular Weight: | 510.59 |
| Molecular Formula: | C31 H30 N2 O5 |
| Smiles: | Cc1ccc2c(c1)N(C(C1=C(CC(CC1=O)c1ccccc1)N2)c1ccc(cc1)OC)C(CCC(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1302 |
| logD: | 2.1808 |
| logSw: | -4.8573 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.565 |
| InChI Key: | AWUVMGNLLWGWBU-UHFFFAOYSA-N |