methyl 4-(2-amino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-(2-amino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutanoate
methyl 4-(2-amino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutanoate
Compound characteristics
| Compound ID: | 8014-1839 |
| Compound Name: | methyl 4-(2-amino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutanoate |
| Molecular Weight: | 253.3 |
| Molecular Formula: | C13 H19 N O4 |
| Smiles: | CC1(C)CC(=C(C(CCC(=O)OC)=O)C(C1)=O)N |
| Stereo: | ACHIRAL |
| logP: | 0.8498 |
| logD: | 0.8349 |
| logSw: | -0.5647 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.287 |
| InChI Key: | PFROFQAJNVDOJX-UHFFFAOYSA-N |