methyl 3-{2-[(butan-2-yl)amino]-2-oxoethyl}-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-{2-[(butan-2-yl)amino]-2-oxoethyl}-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-{2-[(butan-2-yl)amino]-2-oxoethyl}-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-1931 |
| Compound Name: | methyl 3-{2-[(butan-2-yl)amino]-2-oxoethyl}-5-(3,5-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 459.56 |
| Molecular Formula: | C23 H29 N3 O5 S |
| Smiles: | CCC(C)NC(CC1=CSC2=NC(C)=C(C(c3cc(cc(c3)OC)OC)N12)C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0834 |
| logD: | 3.0828 |
| logSw: | -3.2431 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.831 |
| InChI Key: | KBUAFMBWVLDABB-UHFFFAOYSA-N |