N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L087-1359 |
| Compound Name: | N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-3-yl)methyl]carbamimidoyl}-4-methylbenzamide |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C23 H22 N4 O3 |
| Smiles: | Cc1ccc(cc1)C(NC(/NCc1cccnc1)=N/c1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.313 |
| logD: | 1.8475 |
| logSw: | -2.5419 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.192 |
| InChI Key: | BXUYVEAQXHYDNW-UHFFFAOYSA-N |