11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(thiophene-2-carbonyl)-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-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 4780-0079 |
| Compound Name: | 11-(3-fluorophenyl)-3-(4-methoxyphenyl)-10-(thiophene-2-carbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 524.61 |
| Molecular Formula: | C31 H25 F N2 O3 S |
| Smiles: | COc1ccc(cc1)C1CC2=C(C(c3cccc(c3)F)N(C(c3cccs3)=O)c3ccccc3N2)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7373 |
| logD: | 6.6933 |
| logSw: | -5.6522 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.455 |
| InChI Key: | GPJHBWFOIFMUSH-UHFFFAOYSA-N |