11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Chemical Structure Depiction of
11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide
Compound characteristics
| Compound ID: | J024-0222 |
| Compound Name: | 11-(4-fluorophenyl)-3,3-dimethyl-1-oxo-N-[(oxolan-2-yl)methyl]-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepine-10-carboxamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C27 H30 F N3 O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)F)N(C(NCC3CCCO3)=O)c3ccccc3N2)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4535 |
| logD: | 4.4315 |
| logSw: | -4.3575 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.962 |
| InChI Key: | ZMBXBJMZCDPMEO-UHFFFAOYSA-N |