[2-oxo-1-(propan-2-yl)-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl]acetic acid
Chemical Structure Depiction of
[2-oxo-1-(propan-2-yl)-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl]acetic acid
[2-oxo-1-(propan-2-yl)-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl]acetic acid
Compound characteristics
| Compound ID: | S579-0411 |
| Compound Name: | [2-oxo-1-(propan-2-yl)-2,4,5,6,7,7a-hexahydro-1H-indol-3-yl]acetic acid |
| Molecular Weight: | 237.3 |
| Molecular Formula: | C13 H19 N O3 |
| Smiles: | CC(C)N1C2CCCCC2=C(CC(O)=O)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.462 |
| logD: | -1.9869 |
| logSw: | -1.3439 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.629 |
| InChI Key: | LWYFLMQBGVMTHA-LLVKDONJSA-N |