N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
Chemical Structure Depiction of
N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide
Compound characteristics
| Compound ID: | F430-1624 |
| Compound Name: | N-{N'-(2H-1,3-benzodioxol-5-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}-3,4-diethoxybenzamide |
| Molecular Weight: | 462.5 |
| Molecular Formula: | C25 H26 N4 O5 |
| Smiles: | CCOc1ccc(cc1OCC)C(NC(\NCc1ccncc1)=N/c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7368 |
| logD: | 2.259 |
| logSw: | -2.9786 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.815 |
| InChI Key: | QJLHMFFFWTUYTM-UHFFFAOYSA-N |