N-[4-(benzylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-N'-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methyl}methanimidamide
Chemical Structure Depiction of
N-[4-(benzylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-N'-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methyl}methanimidamide
N-[4-(benzylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-N'-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methyl}methanimidamide
Compound characteristics
| Compound ID: | 8007-2547 |
| Compound Name: | N-[4-(benzylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]-N'-{[5-(2-chloro-4-nitrophenyl)furan-2-yl]methyl}methanimidamide |
| Molecular Weight: | 543.41 |
| Molecular Formula: | C24 H23 Cl N8 O3 |
| Salt: | HCl |
| Smiles: | CN(C)c1nc(NCc2ccccc2)nc(N/C=N/Cc2ccc(c3ccc(cc3[Cl])[N+]([O-])=O)o2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.7474 |
| logD: | 5.3206 |
| logSw: | -6.1025 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.935 |
| InChI Key: | ADEZJZWTQULCAH-UHFFFAOYSA-N |