1-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)ethan-1-one
1-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | 8011-5975 |
| Compound Name: | 1-(3-{[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 347.82 |
| Molecular Formula: | C17 H14 Cl N O3 S |
| Smiles: | CC(c1ccc(c(CSc2nc3cc(ccc3o2)[Cl])c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3831 |
| logD: | 4.3831 |
| logSw: | -4.5943 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.087 |
| InChI Key: | PRFVQULPQIEXCV-UHFFFAOYSA-N |