4-({2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl}amino)-4-oxobutanoic acid
Chemical Structure Depiction of
4-({2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl}amino)-4-oxobutanoic acid
4-({2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl}amino)-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 8014-1435 |
| Compound Name: | 4-({2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl}amino)-4-oxobutanoic acid |
| Molecular Weight: | 361.48 |
| Molecular Formula: | C21 H31 N O4 |
| Smiles: | CCC1(C)CC(CCNC(CCC(O)=O)=O)(CCO1)c1ccc(C)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8476 |
| logD: | -0.1018 |
| logSw: | -3.2237 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.249 |
| InChI Key: | JBKSUNPCAFGEPO-UHFFFAOYSA-N |