methyl 3-[4-({[4-(dimethylamino)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)benzamido]benzoate
Chemical Structure Depiction of
methyl 3-[4-({[4-(dimethylamino)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)benzamido]benzoate
methyl 3-[4-({[4-(dimethylamino)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)benzamido]benzoate
Compound characteristics
| Compound ID: | V011-6905 |
| Compound Name: | methyl 3-[4-({[4-(dimethylamino)-5,6-dimethylpyrimidin-2-yl]sulfanyl}methyl)benzamido]benzoate |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C24 H26 N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1c(C)nc(nc1N(C)C)SCc1ccc(cc1)C(Nc1cccc(c1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7184 |
| logD: | 4.529 |
| logSw: | -4.5378 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.84 |
| InChI Key: | DOONUDPVTJVIFL-UHFFFAOYSA-N |