2-(3-methoxyphenyl)-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazin-1-yl}ethan-1-one
2-(3-methoxyphenyl)-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V005-5035 |
| Compound Name: | 2-(3-methoxyphenyl)-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-2-methylpiperazin-1-yl}ethan-1-one |
| Molecular Weight: | 539.55 |
| Molecular Formula: | C29 H28 F3 N3 O4 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(Cc1cccc(c1)OC)=O)C1c2cc(ccc2Oc2ccc(cc2N=1)C(F)(F)F)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4026 |
| logD: | 4.4704 |
| logSw: | -5.5184 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.497 |
| InChI Key: | WXQANKDEWQAMDA-SFHVURJKSA-N |