1'-(2,4,6-trimethylbenzene-1-sulfonyl)spiro[[1,3]benzoxazine-2,4'-piperidin]-4(3H)-one
Chemical Structure Depiction of
1'-(2,4,6-trimethylbenzene-1-sulfonyl)spiro[[1,3]benzoxazine-2,4'-piperidin]-4(3H)-one
1'-(2,4,6-trimethylbenzene-1-sulfonyl)spiro[[1,3]benzoxazine-2,4'-piperidin]-4(3H)-one
Compound characteristics
| Compound ID: | G369-0002 |
| Compound Name: | 1'-(2,4,6-trimethylbenzene-1-sulfonyl)spiro[[1,3]benzoxazine-2,4'-piperidin]-4(3H)-one |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C21 H24 N2 O4 S |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N1CCC2(CC1)NC(c1ccccc1O2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6763 |
| logD: | 3.6763 |
| logSw: | -3.9109 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.184 |
| InChI Key: | YLKYVONUWMFHNB-UHFFFAOYSA-N |