4-(4-benzylpiperidin-1-yl)-N-(4-methylphenyl)-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
4-(4-benzylpiperidin-1-yl)-N-(4-methylphenyl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazin-2-amine--hydrogen chloride (1/1)
4-(4-benzylpiperidin-1-yl)-N-(4-methylphenyl)-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: | 8006-9143 |
| Compound Name: | 4-(4-benzylpiperidin-1-yl)-N-(4-methylphenyl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1,3,5-triazin-2-amine--hydrogen chloride (1/1) |
| Molecular Weight: | 603.08 |
| Molecular Formula: | C30 H30 N8 O4 |
| Salt: | HCl |
| Smiles: | Cc1ccc(cc1)Nc1nc(N/N=C/c2cc3c(cc2[N+]([O-])=O)OCO3)nc(n1)N1CCC(CC1)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 8.3942 |
| logD: | 8.394 |
| logSw: | -5.8546 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 114.727 |
| InChI Key: | QCLDUJKYUXZVNI-FDAWAROLSA-N |