7-{[(5-chloro[1,3]oxazolo[4,5-h]quinolin-2-yl)sulfanyl]methyl}-4,5,6-trimethoxy-2-benzofuran-1(3H)-one
Chemical Structure Depiction of
7-{[(5-chloro[1,3]oxazolo[4,5-h]quinolin-2-yl)sulfanyl]methyl}-4,5,6-trimethoxy-2-benzofuran-1(3H)-one
7-{[(5-chloro[1,3]oxazolo[4,5-h]quinolin-2-yl)sulfanyl]methyl}-4,5,6-trimethoxy-2-benzofuran-1(3H)-one
Compound characteristics
| Compound ID: | 8019-5779 |
| Compound Name: | 7-{[(5-chloro[1,3]oxazolo[4,5-h]quinolin-2-yl)sulfanyl]methyl}-4,5,6-trimethoxy-2-benzofuran-1(3H)-one |
| Molecular Weight: | 472.9 |
| Molecular Formula: | C22 H17 Cl N2 O6 S |
| Smiles: | COc1c2COC(c2c(CSc2nc3cc(c4cccnc4c3o2)[Cl])c(c1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5804 |
| logD: | 4.5804 |
| logSw: | -4.9581 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.12 |
| InChI Key: | CTXICGUBWIEFOB-UHFFFAOYSA-N |