N-(2H-1,3-benzodioxol-5-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G621-0434 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-({5-(hydroxymethyl)-1-[(4-methoxyphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C21 H21 N3 O5 S |
| Smiles: | COc1ccc(Cn2c(CO)cnc2SCC(Nc2ccc3c(c2)OCO3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8476 |
| logD: | 2.8475 |
| logSw: | -3.3211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.168 |
| InChI Key: | AYKRINVPPWXALT-UHFFFAOYSA-N |