methyl 5-amino-6-cyano-2-methyl-7-(3,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate
Chemical Structure Depiction of
methyl 5-amino-6-cyano-2-methyl-7-(3,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate
methyl 5-amino-6-cyano-2-methyl-7-(3,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate
Compound characteristics
Compound ID: | 8016-4485 |
Compound Name: | methyl 5-amino-6-cyano-2-methyl-7-(3,4,5-trimethoxyphenyl)-7H-thieno[3,2-b]pyran-3-carboxylate |
Molecular Weight: | 416.45 |
Molecular Formula: | C20 H20 N2 O6 S |
Smiles: | Cc1c(C(=O)OC)c2c(C(C(C#N)=C(N)O2)c2cc(c(c(c2)OC)OC)OC)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.7618 |
logD: | 2.7618 |
logSw: | -3.1579 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 91.148 |
InChI Key: | AWNRKLNCVOMRKZ-HNNXBMFYSA-N |