N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide
N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | F430-1645 |
| Compound Name: | N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 464.48 |
| Molecular Formula: | C24 H24 N4 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)C(NC(\NCc1ccncc1)=N/c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4021 |
| logD: | 1.9243 |
| logSw: | -2.804 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.373 |
| InChI Key: | AHVGFDNCMBCEMI-UHFFFAOYSA-N |