3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamamido]benzoic acid
Chemical Structure Depiction of
3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamamido]benzoic acid
3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamamido]benzoic acid
Compound characteristics
| Compound ID: | Y043-2489 |
| Compound Name: | 3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)carbamamido]benzoic acid |
| Molecular Weight: | 298.31 |
| Molecular Formula: | C12 H14 N2 O5 S |
| Smiles: | C1CS(CC1NC(Nc1cccc(c1)C(O)=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7652 |
| logD: | -2.1206 |
| logSw: | -2.1002 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.434 |
| InChI Key: | LVYMVYLXGCBEIU-SNVBAGLBSA-N |