1-[4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-2-methylpiperazin-1-yl]-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-2-methylpiperazin-1-yl]-2-(thiophen-2-yl)ethan-1-one
1-[4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-2-methylpiperazin-1-yl]-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V017-0602 |
| Compound Name: | 1-[4-(2-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-2-methylpiperazin-1-yl]-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C26 H27 N3 O3 S |
| Smiles: | CC1CN(CCN1C(Cc1cccs1)=O)C1c2cc(ccc2Oc2cc(C)ccc2N=1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5267 |
| logD: | 3.4988 |
| logSw: | -4.4313 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.971 |
| InChI Key: | FJBSQBYOHMAWKZ-SFHVURJKSA-N |