8-methyl-3-(4-methylpiperazin-1-yl)-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
8-methyl-3-(4-methylpiperazin-1-yl)-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
8-methyl-3-(4-methylpiperazin-1-yl)-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0959 |
| Compound Name: | 8-methyl-3-(4-methylpiperazin-1-yl)-2-(morpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 472.56 |
| Molecular Formula: | C23 H28 N4 O5 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)N1CCN(C)CC1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3453 |
| logD: | 1.9786 |
| logSw: | -3.1527 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.588 |
| InChI Key: | YBAABFGUHTUYKK-UHFFFAOYSA-N |