4-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}butanoic acid
Chemical Structure Depiction of
4-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}butanoic acid
4-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}butanoic acid
Compound characteristics
| Compound ID: | 4533-0025 |
| Compound Name: | 4-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}butanoic acid |
| Molecular Weight: | 253.3 |
| Molecular Formula: | C13 H19 N O4 |
| Smiles: | CC1(C)CC(C(=CNCCCC(O)=O)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1736 |
| logD: | -2.9945 |
| logSw: | -0.3784 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.284 |
| InChI Key: | ZFCHOFCFOBUHEV-UHFFFAOYSA-N |