10-(4-fluorobenzoyl)-11-(4-methoxyphenyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-(4-fluorobenzoyl)-11-(4-methoxyphenyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-(4-fluorobenzoyl)-11-(4-methoxyphenyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
Compound ID: | Y020-6442 |
Compound Name: | 10-(4-fluorobenzoyl)-11-(4-methoxyphenyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
Molecular Weight: | 456.52 |
Molecular Formula: | C28 H25 F N2 O3 |
Smiles: | CC1CC2=C(C(c3ccc(cc3)OC)N(C(c3ccc(cc3)F)=O)c3ccccc3N2)C(C1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.5784 |
logD: | 5.5608 |
logSw: | -5.5435 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.708 |
InChI Key: | IZFNPODHYWCNLN-UHFFFAOYSA-N |