3-{2-[(4-methoxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Chemical Structure Depiction of
3-{2-[(4-methoxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
3-{2-[(4-methoxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Compound characteristics
Compound ID: | 3346-4130 |
Compound Name: | 3-{2-[(4-methoxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione |
Molecular Weight: | 313.27 |
Molecular Formula: | C13 H11 N7 O3 |
Smiles: | COc1ccc(\C=N/Nc2nc3c(C(NC(N3)=O)=O)nn2)cc1 |
Stereo: | ACHIRAL |
logP: | 0.8386 |
logD: | -0.4879 |
logSw: | -2.0064 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 112.072 |
InChI Key: | AQJHVBLOUBAJOS-UHFFFAOYSA-N |