benzyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V021-5690 |
| Compound Name: | benzyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-5-(3,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 583.71 |
| Molecular Formula: | C33 H33 N3 O5 S |
| Smiles: | CC1=C(C(c2ccc(c(c2)OC)OC)N2C(CC(N(C)Cc3ccccc3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3686 |
| logD: | 5.3684 |
| logSw: | -5.4833 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.398 |
| InChI Key: | JKEABNLXKHOEEV-WJOKGBTCSA-N |