4-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-phenyl-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-phenyl-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
4-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-phenyl-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | 8005-6894 |
| Compound Name: | 4-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-N-phenyl-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine |
| Molecular Weight: | 448.44 |
| Molecular Formula: | C21 H20 N8 O4 |
| Smiles: | C1CCN(C1)c1nc(Nc2ccccc2)nc(N/N=C\c2cc3c(cc2[N+]([O-])=O)OCO3)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4757 |
| logD: | 5.4756 |
| logSw: | -5.8404 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 115.364 |
| InChI Key: | TXUYCLSGPCFZGT-UHFFFAOYSA-N |