8-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10-ethyldibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
8-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10-ethyldibenzo[b,f][1,4]oxazepin-11(10H)-one
8-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10-ethyldibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | M014-0401 |
| Compound Name: | 8-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-10-ethyldibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 455.56 |
| Molecular Formula: | C28 H29 N3 O3 |
| Smiles: | CCN1C(c2ccccc2Oc2ccc(cc12)C(N1CCN(CC1)c1cc(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8234 |
| logD: | 4.8234 |
| logSw: | -4.5329 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.169 |
| InChI Key: | YOKPMEVXJJFFCB-UHFFFAOYSA-N |