1-[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-(thiophen-2-yl)ethan-1-one
1-[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V021-4212 |
| Compound Name: | 1-[4-(4-methoxydibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Smiles: | COc1cccc2C(=Nc3ccccc3Oc12)N1CCCN(CC1)C(Cc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5779 |
| logD: | 2.4813 |
| logSw: | -3.9534 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.855 |
| InChI Key: | ZTYUBKZLTNAGMZ-UHFFFAOYSA-N |