N-benzyl-4-(morpholin-4-yl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-benzyl-4-(morpholin-4-yl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
N-benzyl-4-(morpholin-4-yl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8008-9336 |
| Compound Name: | N-benzyl-4-(morpholin-4-yl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazin-2-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 514.93 |
| Molecular Formula: | C22 H22 N8 O5 |
| Salt: | HCl |
| Smiles: | C(c1ccccc1)Nc1nc(N/N=C/c2cc3c(cc2[N+]([O-])=O)OCO3)nc(n1)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.3784 |
| logD: | 4.3768 |
| logSw: | -4.4073 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 124.229 |
| InChI Key: | QFFKEVLOMVAJLE-ZMOGYAJESA-N |