tert-butyl 6-amino-5-cyano-2-methyl-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
tert-butyl 6-amino-5-cyano-2-methyl-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
tert-butyl 6-amino-5-cyano-2-methyl-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8009-3339 |
| Compound Name: | tert-butyl 6-amino-5-cyano-2-methyl-4-(thiophen-2-yl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 318.39 |
| Molecular Formula: | C16 H18 N2 O3 S |
| Smiles: | CC1=C(C(C(C#N)=C(N)O1)c1cccs1)C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6423 |
| logD: | 2.6423 |
| logSw: | -2.9982 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.574 |
| InChI Key: | PKLFFEFPPILVCW-ZDUSSCGKSA-N |