methyl 6-amino-5-cyano-2-(methoxymethyl)-4-(3-methylphenyl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
methyl 6-amino-5-cyano-2-(methoxymethyl)-4-(3-methylphenyl)-4H-pyran-3-carboxylate
methyl 6-amino-5-cyano-2-(methoxymethyl)-4-(3-methylphenyl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8007-0164 |
| Compound Name: | methyl 6-amino-5-cyano-2-(methoxymethyl)-4-(3-methylphenyl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C17 H18 N2 O4 |
| Smiles: | Cc1cccc(c1)C1C(C#N)=C(N)OC(COC)=C1C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8751 |
| logD: | 1.8751 |
| logSw: | -2.2341 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.485 |
| InChI Key: | DBHAWKNUOPQMSL-CQSZACIVSA-N |