4-(3,4-dimethylanilino)-4-oxobutanoic acid
Chemical Structure Depiction of
4-(3,4-dimethylanilino)-4-oxobutanoic acid
4-(3,4-dimethylanilino)-4-oxobutanoic acid
Compound characteristics
| Compound ID: | Y200-6075 |
| Compound Name: | 4-(3,4-dimethylanilino)-4-oxobutanoic acid |
| Molecular Weight: | 221.25 |
| Molecular Formula: | C12 H15 N O3 |
| Smiles: | Cc1ccc(cc1C)NC(CCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.777 |
| logD: | -1.1724 |
| logSw: | -2.1688 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.772 |
| InChI Key: | IOPDCIWZBHGMOA-UHFFFAOYSA-N |