2-(azepane-1-sulfonyl)-3-(4-methylpiperazin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(azepane-1-sulfonyl)-3-(4-methylpiperazin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(azepane-1-sulfonyl)-3-(4-methylpiperazin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0763 |
| Compound Name: | 2-(azepane-1-sulfonyl)-3-(4-methylpiperazin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C24 H30 N4 O4 S |
| Smiles: | CN1CCN(CC1)c1cc2c(cc1S(N1CCCCCC1)(=O)=O)C(Nc1ccccc1O2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7469 |
| logD: | 3.3802 |
| logSw: | -3.9854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.01 |
| InChI Key: | RLQIDDLJGFPYFG-UHFFFAOYSA-N |