N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-5-methylthiophene-2-carboxamide
Chemical Structure Depiction of
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-5-methylthiophene-2-carboxamide
N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-5-methylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | T002-4710 |
| Compound Name: | N-{[1-(but-2-ynoyl)piperidin-4-yl]methyl}-5-methylthiophene-2-carboxamide |
| Molecular Weight: | 304.41 |
| Molecular Formula: | C16 H20 N2 O2 S |
| Smiles: | CC#CC(N1CCC(CC1)CNC(c1ccc(C)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7575 |
| logD: | 2.7575 |
| logSw: | -3.0671 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.063 |
| InChI Key: | KSSXUOSJGGINAJ-UHFFFAOYSA-N |