tert-butyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
Chemical Structure Depiction of
tert-butyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
tert-butyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8009-3333 |
| Compound Name: | tert-butyl 6-amino-5-cyano-4-(2,4-dichlorophenyl)-2-methyl-4H-pyran-3-carboxylate |
| Molecular Weight: | 381.26 |
| Molecular Formula: | C18 H18 Cl2 N2 O3 |
| Smiles: | CC1=C(C(C(C#N)=C(N)O1)c1ccc(cc1[Cl])[Cl])C(=O)OC(C)(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5978 |
| logD: | 4.5978 |
| logSw: | -4.7672 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.556 |
| InChI Key: | XTWGNLCDAUYBOS-OAHLLOKOSA-N |