3-benzyl-5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione
Chemical Structure Depiction of
3-benzyl-5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione
3-benzyl-5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione
Compound characteristics
| Compound ID: | V029-8091 |
| Compound Name: | 3-benzyl-5-{[4-(3,4-dihydroisoquinoline-2(1H)-carbonyl)phenyl]methylidene}-1,3-thiazolidine-2,4-dione |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C27 H22 N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)C(c1ccc(/C=C2/C(N(Cc3ccccc3)C(=O)S2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0397 |
| logD: | 5.0397 |
| logSw: | -4.8962 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.906 |
| InChI Key: | YHAQXORRBXZPHP-UHFFFAOYSA-N |