2-methoxyethyl 2-amino-7,7-dimethyl-5-oxo-4-(pyridin-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
2-methoxyethyl 2-amino-7,7-dimethyl-5-oxo-4-(pyridin-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
2-methoxyethyl 2-amino-7,7-dimethyl-5-oxo-4-(pyridin-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8003-6132 |
| Compound Name: | 2-methoxyethyl 2-amino-7,7-dimethyl-5-oxo-4-(pyridin-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 372.42 |
| Molecular Formula: | C20 H24 N2 O5 |
| Smiles: | CC1(C)CC2=C(C(C(=C(N)O2)C(=O)OCCOC)c2ccncc2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8093 |
| logD: | 0.809 |
| logSw: | -0.8795 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.365 |
| InChI Key: | ABRVHGVEXGVWMK-OAHLLOKOSA-N |