2-{[4-chloro-6-(4-nitroanilino)-1,3,5-triazin-2-yl]amino}ethan-1-ol
Chemical Structure Depiction of
2-{[4-chloro-6-(4-nitroanilino)-1,3,5-triazin-2-yl]amino}ethan-1-ol
2-{[4-chloro-6-(4-nitroanilino)-1,3,5-triazin-2-yl]amino}ethan-1-ol
Compound characteristics
| Compound ID: | K890-0052 |
| Compound Name: | 2-{[4-chloro-6-(4-nitroanilino)-1,3,5-triazin-2-yl]amino}ethan-1-ol |
| Molecular Weight: | 310.7 |
| Molecular Formula: | C11 H11 Cl N6 O3 |
| Smiles: | C(CO)Nc1nc(Nc2ccc(cc2)[N+]([O-])=O)nc(n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.5672 |
| logD: | 2.5672 |
| logSw: | -3.2284 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.404 |
| InChI Key: | PMFOFPSTSTXUIC-UHFFFAOYSA-N |