methyl 5-amino-6-cyano-2-methyl-7-(3-methyl-1-benzothiophen-2-yl)-7H-thieno[3,2-b]pyran-3-carboxylate
Chemical Structure Depiction of
methyl 5-amino-6-cyano-2-methyl-7-(3-methyl-1-benzothiophen-2-yl)-7H-thieno[3,2-b]pyran-3-carboxylate
methyl 5-amino-6-cyano-2-methyl-7-(3-methyl-1-benzothiophen-2-yl)-7H-thieno[3,2-b]pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-7010 |
| Compound Name: | methyl 5-amino-6-cyano-2-methyl-7-(3-methyl-1-benzothiophen-2-yl)-7H-thieno[3,2-b]pyran-3-carboxylate |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C20 H16 N2 O3 S2 |
| Smiles: | Cc1c2ccccc2sc1C1C(C#N)=C(N)Oc2c(C(=O)OC)c(C)sc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4531 |
| logD: | 4.4531 |
| logSw: | -4.7296 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.917 |
| InChI Key: | WRRVKQJEAXTONL-HNNXBMFYSA-N |