2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(2-methyl-2,3-dihydro-1H-indol-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(2-methyl-2,3-dihydro-1H-indol-1-yl)ethan-1-one
2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(2-methyl-2,3-dihydro-1H-indol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y020-1346 |
| Compound Name: | 2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(2-methyl-2,3-dihydro-1H-indol-1-yl)ethan-1-one |
| Molecular Weight: | 458 |
| Molecular Formula: | C22 H20 Cl N3 O2 S2 |
| Smiles: | CC1Cc2ccccc2N1C(CSc1nc(CSc2ccc(cc2)[Cl])cc(n1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1887 |
| logD: | 4.8854 |
| logSw: | -5.266 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.104 |
| InChI Key: | BLMYAPYPIKGCBD-AWEZNQCLSA-N |