3-chloro-8-methyl-2-(thiomorpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-chloro-8-methyl-2-(thiomorpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-chloro-8-methyl-2-(thiomorpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0132 |
| Compound Name: | 3-chloro-8-methyl-2-(thiomorpholine-4-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 424.92 |
| Molecular Formula: | C18 H17 Cl N2 O4 S2 |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)[Cl])S(N1CCSCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3594 |
| logD: | 3.1512 |
| logSw: | -3.8434 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.051 |
| InChI Key: | YDXRQEOQCOGOCP-UHFFFAOYSA-N |