3-[2-(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Chemical Structure Depiction of
3-[2-(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
3-[2-(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Compound characteristics
| Compound ID: | 4065-0325 |
| Compound Name: | 3-[2-(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]pyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione |
| Molecular Weight: | 414.38 |
| Molecular Formula: | C20 H14 N8 O3 |
| Smiles: | C(c1ccccc1)N1C(C(/c2ccccc12)=N/Nc1nc2c(C(NC(N2)=O)=O)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0514 |
| logD: | 0.7248 |
| logSw: | -3.2041 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 118.563 |
| InChI Key: | KYYCSBWCLLDBDP-UHFFFAOYSA-N |