2-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
2-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
2-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0563 |
| Compound Name: | 2-(4-methylpiperidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | CC1CCN(CC1)S(c1cc2C(Nc3ccccc3Oc2cc1N1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5521 |
| logD: | 4.4838 |
| logSw: | -4.3124 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.568 |
| InChI Key: | LPZCFPMTBUVCOH-UHFFFAOYSA-N |