11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 5742-0721 |
| Compound Name: | 11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 484.57 |
| Molecular Formula: | C30 H29 F N2 O3 |
| Smiles: | CC(C)C(N1C(C2=C(CC(CC2=O)c2ccc(cc2)OC)Nc2ccccc12)c1cccc(c1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2326 |
| logD: | 5.9128 |
| logSw: | -5.4997 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.708 |
| InChI Key: | LRDZHUMZLFWVCR-UHFFFAOYSA-N |