4-iodo-2-({2-[4-(4-nitroanilino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)phenol
Chemical Structure Depiction of
4-iodo-2-({2-[4-(4-nitroanilino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)phenol
4-iodo-2-({2-[4-(4-nitroanilino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)phenol
Compound characteristics
| Compound ID: | 8002-5953 |
| Compound Name: | 4-iodo-2-({2-[4-(4-nitroanilino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl)phenol |
| Molecular Weight: | 546.33 |
| Molecular Formula: | C20 H19 I N8 O3 |
| Smiles: | C1CCN(C1)c1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(N/N=C/c2cc(ccc2O)I)n1 |
| Stereo: | ACHIRAL |
| logP: | 7.1194 |
| logD: | 7.1114 |
| logSw: | -5.8794 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.098 |
| InChI Key: | DYBHWKXZSRQRKC-UHFFFAOYSA-N |