N-(3-chloro-4-methylphenyl)-5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carboxamide
N-(3-chloro-4-methylphenyl)-5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8016-3610 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carboxamide |
| Molecular Weight: | 333.83 |
| Molecular Formula: | C17 H16 Cl N O2 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(c1ccc(C#CC(C)(C)O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5921 |
| logD: | 5.5798 |
| logSw: | -5.6176 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.535 |
| InChI Key: | KKVVKJHJWNNIAP-UHFFFAOYSA-N |