ethyl 1-(1-methyl-2,3,5-trioxo-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyrazine-9-sulfonyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(1-methyl-2,3,5-trioxo-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyrazine-9-sulfonyl)piperidine-4-carboxylate
ethyl 1-(1-methyl-2,3,5-trioxo-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyrazine-9-sulfonyl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C301-5928 |
| Compound Name: | ethyl 1-(1-methyl-2,3,5-trioxo-1,3,4,5-tetrahydro-2H-[1]benzopyrano[3,4-b]pyrazine-9-sulfonyl)piperidine-4-carboxylate |
| Molecular Weight: | 463.46 |
| Molecular Formula: | C20 H21 N3 O8 S |
| Smiles: | CCOC(C1CCN(CC1)S(c1ccc2c(c1)C1=C(C(=O)O2)NC(C(N1C)=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6391 |
| logD: | -0.6656 |
| logSw: | -2.6355 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.893 |
| InChI Key: | CFZOVPZFCBDLKM-UHFFFAOYSA-N |