10-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Chemical Structure Depiction of
10-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
10-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Compound characteristics
| Compound ID: | 8014-3142 |
| Compound Name: | 10-{[4-(benzyloxy)-5-methoxy-2-nitrophenyl]methylidene}-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one |
| Molecular Weight: | 636.13 |
| Molecular Formula: | C35 H26 Cl N3 O5 S |
| Smiles: | COc1cc(\C=C2/C(N3C(C4CCc5ccccc5C=4N=C3S2)c2ccccc2[Cl])=O)c(cc1OCc1ccccc1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.7367 |
| logD: | 6.3103 |
| logSw: | -6.3902 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.225 |
| InChI Key: | PTJSQLMMPYEKSG-MGBGTMOVSA-N |