3-{2-[(4-hydroxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Chemical Structure Depiction of
3-{2-[(4-hydroxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
3-{2-[(4-hydroxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Compound characteristics
| Compound ID: | 4065-0316 |
| Compound Name: | 3-{2-[(4-hydroxyphenyl)methylidene]hydrazinyl}pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione |
| Molecular Weight: | 299.25 |
| Molecular Formula: | C12 H9 N7 O3 |
| Smiles: | C(/c1ccc(cc1)O)=N/Nc1nc2c(C(NC(N2)=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 0.2365 |
| logD: | -1.0901 |
| logSw: | -1.8238 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 122.145 |
| InChI Key: | IBKRVZMRMWVJKF-ACAGNQJTSA-N |