benzyl 5-(3,5-dimethoxyphenyl)-3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 5-(3,5-dimethoxyphenyl)-3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 5-(3,5-dimethoxyphenyl)-3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V003-7797 |
| Compound Name: | benzyl 5-(3,5-dimethoxyphenyl)-3-{2-[3-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 619.74 |
| Molecular Formula: | C33 H37 N3 O7 S |
| Smiles: | CCOC(C1CCCN(C1)C(CC1=CSC2=NC(C)=C(C(c3cc(cc(c3)OC)OC)N12)C(=O)OCc1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6984 |
| logD: | 4.6982 |
| logSw: | -4.7684 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.41 |
| InChI Key: | IPNVTJQHOWATFO-UHFFFAOYSA-N |