3-(4-chlorophenyl)-10-hexanoyl-11-(3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-10-hexanoyl-11-(3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3-(4-chlorophenyl)-10-hexanoyl-11-(3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
Compound ID: | 4038-0034 |
Compound Name: | 3-(4-chlorophenyl)-10-hexanoyl-11-(3-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
Molecular Weight: | 529.08 |
Molecular Formula: | C32 H33 Cl N2 O3 |
Smiles: | CCCCCC(N1C(C2=C(CC(CC2=O)c2ccc(cc2)[Cl])Nc2ccccc12)c1cccc(c1)OC)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 7.8487 |
logD: | 7.5289 |
logSw: | -6.4323 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.181 |
InChI Key: | FIGNKWDRYFQGOP-UHFFFAOYSA-N |