1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}-2-phenylbutan-1-one
Chemical Structure Depiction of
1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}-2-phenylbutan-1-one
1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | V005-5073 |
| Compound Name: | 1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}-2-phenylbutan-1-one |
| Molecular Weight: | 537.58 |
| Molecular Formula: | C30 H30 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCCN(CC1)C1c2cc(ccc2Oc2ccc(cc2N=1)C(F)(F)F)OC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0607 |
| logD: | 4.4624 |
| logSw: | -5.6335 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.593 |
| InChI Key: | JWCGVJWUFDVPEH-HSZRJFAPSA-N |