5-amino-7-[4-(benzyloxy)phenyl]-2-{[4-(benzyloxy)phenyl]methylidene}-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Chemical Structure Depiction of
5-amino-7-[4-(benzyloxy)phenyl]-2-{[4-(benzyloxy)phenyl]methylidene}-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
5-amino-7-[4-(benzyloxy)phenyl]-2-{[4-(benzyloxy)phenyl]methylidene}-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Compound characteristics
| Compound ID: | 8009-5125 |
| Compound Name: | 5-amino-7-[4-(benzyloxy)phenyl]-2-{[4-(benzyloxy)phenyl]methylidene}-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile |
| Molecular Weight: | 594.69 |
| Molecular Formula: | C36 H26 N4 O3 S |
| Smiles: | C(c1ccccc1)Oc1ccc(\C=C2/C(N3C(=C(C#N)C(C(C#N)=C3S2)c2ccc(cc2)OCc2ccccc2)N)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1602 |
| logD: | 6.1602 |
| logSw: | -5.9341 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.857 |
| InChI Key: | FDEIFTLCDWDBER-XIFFEERXSA-N |