10-acetyl-3-(4-fluorophenyl)-11-[4-(pentyloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-acetyl-3-(4-fluorophenyl)-11-[4-(pentyloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-acetyl-3-(4-fluorophenyl)-11-[4-(pentyloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | Y600-1357 |
| Compound Name: | 10-acetyl-3-(4-fluorophenyl)-11-[4-(pentyloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 512.62 |
| Molecular Formula: | C32 H33 F N2 O3 |
| Smiles: | CCCCCOc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)F)Nc2ccccc2N1C(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.2283 |
| logD: | 6.9085 |
| logSw: | -5.5644 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.05 |
| InChI Key: | PMCBPPVJFSTHOA-UHFFFAOYSA-N |