N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-dimethoxybenzamide
N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | F430-1615 |
| Compound Name: | N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 434.45 |
| Molecular Formula: | C23 H22 N4 O5 |
| Smiles: | COc1ccc(cc1OC)C(NC(\NCc1ccncc1)=N/c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2455 |
| logD: | 1.7677 |
| logSw: | -2.7837 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.656 |
| InChI Key: | CBUNYNULYXIHCT-UHFFFAOYSA-N |