1-(2,3-dihydro-1H-indol-1-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | G621-0413 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | COc1ccc(Cn2c(CO)cnc2SCC(N2CCc3ccccc23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1136 |
| logD: | 3.113 |
| logSw: | -3.1554 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.326 |
| InChI Key: | QIQMCXYYUZRLQA-UHFFFAOYSA-N |