7,9-dimethylpyrimido[4',5':3,4]pyrrolo[2,1-c][1,2,4]benzotriazine-8,10(7H,9H)-dione
Chemical Structure Depiction of
7,9-dimethylpyrimido[4',5':3,4]pyrrolo[2,1-c][1,2,4]benzotriazine-8,10(7H,9H)-dione
7,9-dimethylpyrimido[4',5':3,4]pyrrolo[2,1-c][1,2,4]benzotriazine-8,10(7H,9H)-dione
Compound characteristics
| Compound ID: | 8013-0720 |
| Compound Name: | 7,9-dimethylpyrimido[4',5':3,4]pyrrolo[2,1-c][1,2,4]benzotriazine-8,10(7H,9H)-dione |
| Molecular Weight: | 281.27 |
| Molecular Formula: | C14 H11 N5 O2 |
| Smiles: | CN1C(c2cn3c4ccccc4N=Nc3c2N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5387 |
| logD: | 2.5387 |
| logSw: | -2.5966 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.798 |
| InChI Key: | PTBSYXYYPCLRGH-UHFFFAOYSA-N |