methyl 4-[2-amino-3-cyano-5-(diethoxyphosphoryl)-6-phenyl-4H-pyran-4-yl]benzoate
Chemical Structure Depiction of
methyl 4-[2-amino-3-cyano-5-(diethoxyphosphoryl)-6-phenyl-4H-pyran-4-yl]benzoate
methyl 4-[2-amino-3-cyano-5-(diethoxyphosphoryl)-6-phenyl-4H-pyran-4-yl]benzoate
Compound characteristics
| Compound ID: | 8019-5010 |
| Compound Name: | methyl 4-[2-amino-3-cyano-5-(diethoxyphosphoryl)-6-phenyl-4H-pyran-4-yl]benzoate |
| Molecular Weight: | 468.45 |
| Molecular Formula: | C24 H25 N2 O6 P |
| Smiles: | CCOP(C1C(C(C#N)=C(N)OC=1c1ccccc1)c1ccc(cc1)C(=O)OC)(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2453 |
| logD: | 3.2453 |
| logSw: | -3.4366 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.044 |
| InChI Key: | MSMMNYASRJRXHP-FQEVSTJZSA-N |