4-tert-butyl-N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-tert-butyl-N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
4-tert-butyl-N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | C301-4539 |
| Compound Name: | 4-tert-butyl-N-[4-(ethylamino)-2-oxo-2H-1-benzopyran-3-yl]benzene-1-sulfonamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C21 H24 N2 O4 S |
| Smiles: | CCNC1=C(C(=O)Oc2ccccc12)NS(c1ccc(cc1)C(C)(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9689 |
| logD: | -0.6678 |
| logSw: | -4.1419 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.34 |
| InChI Key: | KEYMETBVAAZCJR-UHFFFAOYSA-N |