3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(morpholine-4-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-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0927 |
| Compound Name: | 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-8-methyl-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 562.69 |
| Molecular Formula: | C30 H34 N4 O5 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)N1CCN(CC1)c1cccc(C)c1C)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2861 |
| logD: | 5.24 |
| logSw: | -5.2901 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.071 |
| InChI Key: | IAPGNUGVGMUAEM-UHFFFAOYSA-N |