methyl 4-[2-(1-benzyl-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(1-benzyl-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetamido]benzoate
methyl 4-[2-(1-benzyl-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | 8013-5346 |
| Compound Name: | methyl 4-[2-(1-benzyl-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetamido]benzoate |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C27 H33 N3 O4 S |
| Smiles: | CCCCCCCN1C(CC(Nc2ccc(cc2)C(=O)OC)=O)C(N(Cc2ccccc2)C1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6224 |
| logD: | 5.6221 |
| logSw: | -5.3061 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.432 |
| InChI Key: | QYWMZQCHCMNHOR-HSZRJFAPSA-N |