2-{[(3,4-dimethoxyphenyl)methyl]amino}-4-(propan-2-yl)pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
2-{[(3,4-dimethoxyphenyl)methyl]amino}-4-(propan-2-yl)pyrimidine-5-carboxylic acid
2-{[(3,4-dimethoxyphenyl)methyl]amino}-4-(propan-2-yl)pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | S272-2102 |
| Compound Name: | 2-{[(3,4-dimethoxyphenyl)methyl]amino}-4-(propan-2-yl)pyrimidine-5-carboxylic acid |
| Molecular Weight: | 331.37 |
| Molecular Formula: | C17 H21 N3 O4 |
| Smiles: | CC(C)c1c(cnc(NCc2ccc(c(c2)OC)OC)n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7955 |
| logD: | 1.9513 |
| logSw: | -3.1013 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.14 |
| InChI Key: | VYHQYHUOHBQYKF-UHFFFAOYSA-N |