4-chloro-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-chloro-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide
4-chloro-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F430-0072 |
| Compound Name: | 4-chloro-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(pyridin-4-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 422.87 |
| Molecular Formula: | C22 H19 Cl N4 O3 |
| Smiles: | C(c1ccncc1)N\C(NC(c1ccc(cc1)[Cl])=O)=N/c1ccc2c(c1)OCCO2 |
| Stereo: | ACHIRAL |
| logP: | 2.3555 |
| logD: | 1.554 |
| logSw: | -3.4563 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.103 |
| InChI Key: | YPYBHSQVTKUEQL-UHFFFAOYSA-N |