ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4490-2398 |
| Compound Name: | ethyl 5-(4-chlorophenyl)-7-methyl-2-{[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 549 |
| Molecular Formula: | C27 H21 Cl N4 O5 S |
| Smiles: | CCOC(C1C(c2ccc(cc2)[Cl])N2C(=NC=1C)SC(=C\c1cccn1c1ccc(cc1)[N+]([O-])=O)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9474 |
| logD: | 5.9474 |
| logSw: | -6.2997 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.658 |
| InChI Key: | LSYSBRNSOBJRCO-DEOSSOPVSA-N |