N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-4-(propan-2-yl)benzamide
Chemical Structure Depiction of
N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-4-(propan-2-yl)benzamide
N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-4-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | T002-1355 |
| Compound Name: | N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-4-(propan-2-yl)benzamide |
| Molecular Weight: | 298.38 |
| Molecular Formula: | C18 H22 N2 O2 |
| Smiles: | CC#CC(N1CCC(C1)NC(c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0635 |
| logD: | 3.0635 |
| logSw: | -3.1706 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.877 |
| InChI Key: | UDMHFCGJACWTEN-INIZCTEOSA-N |