ethyl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-7868 |
| Compound Name: | ethyl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(3-methylphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 567.66 |
| Molecular Formula: | C32 H29 N3 O5 S |
| Smiles: | CCOC(C1C(c2cccc(C)c2)N2C(CC(NCc3ccc4c(c3)OCO4)=O)=CSC2=NC=1c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1354 |
| logD: | 6.1296 |
| logSw: | -5.5175 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.955 |
| InChI Key: | LBYOPXQLLGJBOD-SSEXGKCCSA-N |