3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(piperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(piperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(piperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0829 |
| Compound Name: | 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(piperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 560.72 |
| Molecular Formula: | C31 H36 N4 O4 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)N1CCN(CC1)c1cccc(C)c1C)S(N1CCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2755 |
| logD: | 6.2294 |
| logSw: | -5.3414 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.162 |
| InChI Key: | AFCZONCCOILDIH-UHFFFAOYSA-N |