2-cyclopentyl-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-cyclopentyl-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
2-cyclopentyl-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V005-5062 |
| Compound Name: | 2-cyclopentyl-1-{4-[2-methoxy-8-(trifluoromethyl)dibenzo[b,f][1,4]oxazepin-11-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 501.55 |
| Molecular Formula: | C27 H30 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc2c(c1)C(=Nc1cc(ccc1O2)C(F)(F)F)N1CCCN(CC1)C(CC1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2303 |
| logD: | 3.632 |
| logSw: | -5.239 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.624 |
| InChI Key: | XGDQNBYUPNTTCX-UHFFFAOYSA-N |