(10E)-10-{[2-(benzyloxy)-3,5-diiodophenyl]methylidene}-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Chemical Structure Depiction of
(10E)-10-{[2-(benzyloxy)-3,5-diiodophenyl]methylidene}-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
(10E)-10-{[2-(benzyloxy)-3,5-diiodophenyl]methylidene}-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Compound characteristics
| Compound ID: | IB01-9541 |
| Compound Name: | (10E)-10-{[2-(benzyloxy)-3,5-diiodophenyl]methylidene}-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one |
| Molecular Weight: | 796.44 |
| Molecular Formula: | C34 H23 F I2 N2 O2 S |
| Smiles: | C1Cc2ccccc2C2=C1C(c1ccc(cc1)F)N1C(=N2)SC(=C\c2cc(cc(c2OCc2ccccc2)I)I)\C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 10.02 |
| logD: | 10.02 |
| logSw: | -9.69 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 72.1 |
| InChI Key: | KGVDWCSYAJDUFC-WJOKGBTCSA-N |