N-(4-fluorophenyl)-2-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
N-(4-fluorophenyl)-2-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide
Compound characteristics
| Compound ID: | J024-0136 |
| Compound Name: | N-(4-fluorophenyl)-2-[1-oxo-11-(thiophen-2-yl)-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C25 H22 F N3 O2 S |
| Smiles: | C1CC2=C(C(c3cccs3)N(CC(Nc3ccc(cc3)F)=O)c3ccccc3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8792 |
| logD: | 4.8655 |
| logSw: | -4.7928 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.748 |
| InChI Key: | XTHBDTKCZISFML-VWLOTQADSA-N |