3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one
3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one
Compound characteristics
| Compound ID: | 1683-6798 |
| Compound Name: | 3-{2-[(4-chloro-3-nitrophenyl)methylidene]hydrazinyl}-6-methyl-1,2,4-triazin-5(4H)-one |
| Molecular Weight: | 308.68 |
| Molecular Formula: | C11 H9 Cl N6 O3 |
| Smiles: | CC1C(NC(N/N=C/c2ccc(c(c2)[N+]([O-])=O)[Cl])=NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1281 |
| logD: | 2.1065 |
| logSw: | -3.36 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.602 |
| InChI Key: | TYJXYOANXFRADL-UHFFFAOYSA-N |