methyl 5-chloro-4-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}-2-methoxybenzoate
Chemical Structure Depiction of
methyl 5-chloro-4-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}-2-methoxybenzoate
methyl 5-chloro-4-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}-2-methoxybenzoate
Compound characteristics
| Compound ID: | 1683-1097 |
| Compound Name: | methyl 5-chloro-4-{[(2,2-dimethylpropanoyl)carbamothioyl]amino}-2-methoxybenzoate |
| Molecular Weight: | 358.84 |
| Molecular Formula: | C15 H19 Cl N2 O4 S |
| Smiles: | CC(C)(C)C(NC(Nc1cc(c(cc1[Cl])C(=O)OC)OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0254 |
| logD: | 3.4766 |
| logSw: | -4.4368 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.618 |
| InChI Key: | OGEIDSIJUQSNRC-UHFFFAOYSA-N |