N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({1-[(4-methylphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({1-[(4-methylphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({1-[(4-methylphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G856-2119 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({1-[(4-methylphenyl)methyl]-1H-imidazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | [H]N(C(CSc1nccn1Cc1ccc(C)cc1)=O)c1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.7722 |
| logD: | 2.7717 |
| logSw: | -3.2008 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.031 |
| InChI Key: | XYUPPGFGHYJCPX-UHFFFAOYSA-N |