3-[4-(4-fluorophenyl)piperazin-1-yl]-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-[4-(4-fluorophenyl)piperazin-1-yl]-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-[4-(4-fluorophenyl)piperazin-1-yl]-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0977 |
| Compound Name: | 3-[4-(4-fluorophenyl)piperazin-1-yl]-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 564.68 |
| Molecular Formula: | C30 H33 F N4 O4 S |
| Smiles: | CC1CCN(CC1)S(c1cc2C(Nc3cc(C)ccc3Oc2cc1N1CCN(CC1)c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7766 |
| logD: | 5.7305 |
| logSw: | -5.5223 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.463 |
| InChI Key: | YOBGRIAUWKCYPR-UHFFFAOYSA-N |