2-{1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethylidene}-1H-indene-1,3(2H)-dione
Chemical Structure Depiction of
2-{1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethylidene}-1H-indene-1,3(2H)-dione
2-{1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethylidene}-1H-indene-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3536-0009 |
| Compound Name: | 2-{1-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]ethylidene}-1H-indene-1,3(2H)-dione |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C25 H18 N2 O2 S |
| Smiles: | CC(=C1C(c2ccccc2C1=O)=O)Nc1ccc(cc1)c1nc2ccc(C)cc2s1 |
| Stereo: | ACHIRAL |
| logP: | 5.8395 |
| logD: | 5.8394 |
| logSw: | -5.4862 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.217 |
| InChI Key: | JIXNSBNPVFGJCT-UHFFFAOYSA-N |