N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(3-methoxyphenoxy)pyrimidin-4-yl]benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(3-methoxyphenoxy)pyrimidin-4-yl]benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(3-methoxyphenoxy)pyrimidin-4-yl]benzamide
Compound characteristics
| Compound ID: | L533-0385 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[6-(3-methoxyphenoxy)pyrimidin-4-yl]benzamide |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C26 H21 N3 O5 |
| Smiles: | COc1cccc(c1)Oc1cc(c2ccc(cc2)C(NCc2ccc3c(c2)OCO3)=O)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.2984 |
| logD: | 4.2984 |
| logSw: | -4.4696 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.498 |
| InChI Key: | NIVDXZXMFVCIAQ-UHFFFAOYSA-N |