3-(4-bromobenzene-1-sulfonyl)-7-(diethylamino)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-7-(diethylamino)-2H-1-benzopyran-2-one
3-(4-bromobenzene-1-sulfonyl)-7-(diethylamino)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0249 |
| Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-7-(diethylamino)-2H-1-benzopyran-2-one |
| Molecular Weight: | 436.32 |
| Molecular Formula: | C19 H18 Br N O4 S |
| Smiles: | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5876 |
| logD: | 4.5875 |
| logSw: | -4.5389 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.397 |
| InChI Key: | NZELFECSGYQMPW-UHFFFAOYSA-N |