2-amino-4-(5-bromothiophen-2-yl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-bromothiophen-2-yl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
2-amino-4-(5-bromothiophen-2-yl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Compound characteristics
| Compound ID: | 7954-3904 |
| Compound Name: | 2-amino-4-(5-bromothiophen-2-yl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile |
| Molecular Weight: | 381.2 |
| Molecular Formula: | C14 H9 Br N2 O4 S |
| Smiles: | C(C1=CC(C2=C(C(C(C#N)=C(N)O2)c2ccc(s2)[Br])O1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.478 |
| logD: | 1.478 |
| logSw: | -1.9117 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.728 |
| InChI Key: | NWCLGSUXTMRQFA-LLVKDONJSA-N |