3-(1,3-benzothiazol-2-yl)-7-(diethylamino)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-7-(diethylamino)-2H-1-benzopyran-2-one
3-(1,3-benzothiazol-2-yl)-7-(diethylamino)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K259-0004 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-7-(diethylamino)-2H-1-benzopyran-2-one |
| Molecular Weight: | 350.44 |
| Molecular Formula: | C20 H18 N2 O2 S |
| Smiles: | CCN(CC)c1ccc2C=C(C(=O)Oc2c1)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8704 |
| logD: | 4.8703 |
| logSw: | -4.786 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.345 |
| InChI Key: | VBVAVBCYMYWNOU-UHFFFAOYSA-N |