1-{2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2-(phenylsulfanyl)ethan-1-one
Chemical Structure Depiction of
1-{2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2-(phenylsulfanyl)ethan-1-one
1-{2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2-(phenylsulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | V010-3773 |
| Compound Name: | 1-{2-[5-(2-methoxyphenyl)-1,3-benzoxazol-2-yl]pyrrolidin-1-yl}-2-(phenylsulfanyl)ethan-1-one |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C26 H24 N2 O3 S |
| Smiles: | COc1ccccc1c1ccc2c(c1)nc(C1CCCN1C(CSc1ccccc1)=O)o2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1647 |
| logD: | 5.1647 |
| logSw: | -4.9221 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.588 |
| InChI Key: | LZPGOKWBXBJUQA-QFIPXVFZSA-N |