N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3-methylbenzamide
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | L086-1353 |
| Compound Name: | N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-3-methylbenzamide |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C23 H22 N4 O3 |
| Smiles: | Cc1cccc(c1)C(NC(/NCc1ccccn1)=N/c1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5785 |
| logD: | 1.5348 |
| logSw: | -2.9965 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.218 |
| InChI Key: | MUERFSFQKMCIMU-UHFFFAOYSA-N |