methyl 3-butanamido-4-[(4-chlorophenyl)sulfanyl]benzoate
Chemical Structure Depiction of
methyl 3-butanamido-4-[(4-chlorophenyl)sulfanyl]benzoate
methyl 3-butanamido-4-[(4-chlorophenyl)sulfanyl]benzoate
Compound characteristics
| Compound ID: | K783-4815 |
| Compound Name: | methyl 3-butanamido-4-[(4-chlorophenyl)sulfanyl]benzoate |
| Molecular Weight: | 363.86 |
| Molecular Formula: | C18 H18 Cl N O3 S |
| Smiles: | CCCC(Nc1cc(ccc1Sc1ccc(cc1)[Cl])C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1967 |
| logD: | 5.1967 |
| logSw: | -5.6992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.592 |
| InChI Key: | MCWUCMROOOVAMQ-UHFFFAOYSA-N |