7-(2-chlorophenyl)-10-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Chemical Structure Depiction of
7-(2-chlorophenyl)-10-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
7-(2-chlorophenyl)-10-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Compound characteristics
| Compound ID: | 8017-9933 |
| Compound Name: | 7-(2-chlorophenyl)-10-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one |
| Molecular Weight: | 543.98 |
| Molecular Formula: | C28 H18 Cl N3 O5 S |
| Smiles: | C1Cc2ccccc2C2=C1C(c1ccccc1[Cl])N1C(=N2)SC(=C/c2cc3c(cc2[N+]([O-])=O)OCO3)\C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7081 |
| logD: | 5.2817 |
| logSw: | -6.4452 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.396 |
| InChI Key: | LTUQFINOHWIOIX-AREMUKBSSA-N |