N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide
Compound characteristics
Compound ID: | F937-0513 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-(propan-2-yl)pyrimidine-5-carboxamide |
Molecular Weight: | 313.35 |
Molecular Formula: | C17 H19 N3 O3 |
Smiles: | CC(C)c1ncc(C(NCc2ccc3c(c2)OCO3)=O)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 2.6489 |
logD: | 2.6488 |
logSw: | -3.0537 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.437 |
InChI Key: | GCUTXQGOWINNMY-UHFFFAOYSA-N |