ethyl 2-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-(2-methoxynaphthalen-1-yl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-(2-methoxynaphthalen-1-yl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-(2-methoxynaphthalen-1-yl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3270-0884 |
| Compound Name: | ethyl 2-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-(2-methoxynaphthalen-1-yl)-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 674.22 |
| Molecular Formula: | C39 H32 Cl N3 O4 S |
| Smiles: | CCOC(C1C(c2c(ccc3ccccc23)OC)N2C(=NC=1c1ccccc1)SC(=C/c1cc(C)n(c3ccc(cc3)[Cl])c1C)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.6889 |
| logD: | 8.6888 |
| logSw: | -6.7077 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.001 |
| InChI Key: | HKAYRHDTCPBZNS-PSXMRANNSA-N |