2-[11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-propylacetamide
Chemical Structure Depiction of
2-[11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-propylacetamide
2-[11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-propylacetamide
Compound characteristics
| Compound ID: | J024-0035 |
| Compound Name: | 2-[11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-N-propylacetamide |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C26 H30 F N3 O2 |
| Smiles: | CCCNC(CN1C(C2=C(CC(C)(C)CC2=O)Nc2ccccc12)c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5052 |
| logD: | 4.4853 |
| logSw: | -4.2464 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.165 |
| InChI Key: | PBXKFFGDDGDQLD-VWLOTQADSA-N |