N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(diethylamino)-2-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(diethylamino)-2-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(diethylamino)-2-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V028-1284 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-(diethylamino)-2-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C26 H30 N4 O6 |
| Smiles: | CCN(CC)c1c(cnc(c2cc(c(c(c2)OC)OC)OC)n1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0262 |
| logD: | 3.912 |
| logSw: | -4.0926 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.236 |
| InChI Key: | RWYGNVZBWCVARY-UHFFFAOYSA-N |