4-(acetamidomethyl)-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
4-(acetamidomethyl)-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
4-(acetamidomethyl)-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | L088-1381 |
| Compound Name: | 4-(acetamidomethyl)-N-{N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(oxolan-2-yl)methyl]carbamimidoyl}benzamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C24 H28 N4 O5 |
| Smiles: | CC(NCc1ccc(cc1)C(NC(/NCC1CCCO1)=N/c1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4167 |
| logD: | 0.297 |
| logSw: | -1.928 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.913 |
| InChI Key: | DVRXYJDSZUUSOC-HXUWFJFHSA-N |