4-tert-butyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
4-tert-butyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide
Compound characteristics
| Compound ID: | G411-0111 |
| Compound Name: | 4-tert-butyl-N-[2-oxo-4-(pyrrolidin-1-yl)-2H-1-benzopyran-3-yl]benzamide |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C24 H26 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(NC1=C(c2ccccc2OC1=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0791 |
| logD: | 4.0726 |
| logSw: | -4.8268 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.187 |
| InChI Key: | QDNNJNPKSVEWRS-UHFFFAOYSA-N |