N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | L086-1352 |
| Compound Name: | N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-2-yl)methyl]carbamimidoyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 432.43 |
| Molecular Formula: | C23 H20 N4 O5 |
| Smiles: | C(c1ccccn1)N/C(NC(c1ccc2c(c1)OCO2)=O)=N/c1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.1299 |
| logD: | 1.0861 |
| logSw: | -2.9757 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.333 |
| InChI Key: | WHWIVNMVNWVQEP-UHFFFAOYSA-N |