N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
Chemical Structure Depiction of
N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
Compound characteristics
| Compound ID: | T002-1466 |
| Compound Name: | N-[1-(but-2-ynoyl)pyrrolidin-3-yl]-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide |
| Molecular Weight: | 327.34 |
| Molecular Formula: | C17 H17 N3 O4 |
| Smiles: | CC#CC(N1CCC(C1)NC(CN1C(=O)Oc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1093 |
| logD: | 1.1093 |
| logSw: | -2.0805 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.764 |
| InChI Key: | GTOHINQGJHVUKX-LBPRGKRZSA-N |