2-imino-2,3-dihydro-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
Chemical Structure Depiction of
2-imino-2,3-dihydro-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
2-imino-2,3-dihydro-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
Compound characteristics
| Compound ID: | 8018-5711 |
| Compound Name: | 2-imino-2,3-dihydro-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one |
| Molecular Weight: | 202.17 |
| Molecular Formula: | C9 H6 N4 O2 |
| Smiles: | c1ccc2c(c1)N1C(=NC(=N)NC1=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 0.0562 |
| logD: | 0.0562 |
| logSw: | -1.9277 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.085 |
| InChI Key: | MKAOREYFJCTWPB-UHFFFAOYSA-N |