methyl 6-amino-4-(5-bromothiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
Chemical Structure Depiction of
methyl 6-amino-4-(5-bromothiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
methyl 6-amino-4-(5-bromothiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8009-4797 |
| Compound Name: | methyl 6-amino-4-(5-bromothiophen-2-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate |
| Molecular Weight: | 355.21 |
| Molecular Formula: | C13 H11 Br N2 O3 S |
| Smiles: | CC1=C(C(C(C#N)=C(N)O1)c1ccc(s1)[Br])C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3507 |
| logD: | 2.3507 |
| logSw: | -2.6405 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.885 |
| InChI Key: | JSYINMWGVJATLE-NSHDSACASA-N |