ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(thiophen-3-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(thiophen-3-yl)-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(thiophen-3-yl)-4H-pyran-3-carboxylate
Compound characteristics
Compound ID: | 8008-1691 |
Compound Name: | ethyl 6-amino-5-cyano-2-(2-ethoxy-2-oxoethyl)-4-(thiophen-3-yl)-4H-pyran-3-carboxylate |
Molecular Weight: | 362.4 |
Molecular Formula: | C17 H18 N2 O5 S |
Smiles: | CCOC(CC1=C(C(C(C#N)=C(N)O1)c1ccsc1)C(=O)OCC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.9387 |
logD: | 1.9387 |
logSw: | -2.4005 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.818 |
InChI Key: | BVUTXUFMKKSBGZ-CQSZACIVSA-N |