5-(3-hydroxy-3-methylbut-1-yn-1-yl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
5-(3-hydroxy-3-methylbut-1-yn-1-yl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
5-(3-hydroxy-3-methylbut-1-yn-1-yl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8015-2723 |
| Compound Name: | 5-(3-hydroxy-3-methylbut-1-yn-1-yl)-N-[(4-methylphenyl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 313.42 |
| Molecular Formula: | C18 H19 N O2 S |
| Smiles: | Cc1ccc(CNC(c2ccc(C#CC(C)(C)O)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2135 |
| logD: | 4.2135 |
| logSw: | -4.1243 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.857 |
| InChI Key: | BJUUQGSRXAGNBS-UHFFFAOYSA-N |