2-(3-methoxyphenyl)-1-{4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-{4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
2-(3-methoxyphenyl)-1-{4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V004-3769 |
| Compound Name: | 2-(3-methoxyphenyl)-1-{4-[7-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 509.53 |
| Molecular Formula: | C28 H26 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(CC(N2CCCN(CC2)C2c3ccccc3Oc3cc(ccc3N=2)C(F)(F)F)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2051 |
| logD: | 4.1028 |
| logSw: | -5.1276 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.065 |
| InChI Key: | SXTYHUUVFSZAIG-UHFFFAOYSA-N |