methyl 3-{2-[(bicyclo[2.2.1]heptan-2-yl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-{2-[(bicyclo[2.2.1]heptan-2-yl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-{2-[(bicyclo[2.2.1]heptan-2-yl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V017-0229 |
| Compound Name: | methyl 3-{2-[(bicyclo[2.2.1]heptan-2-yl)amino]-2-oxoethyl}-5-(2,5-dimethylphenyl)-7-ethyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 479.64 |
| Molecular Formula: | C27 H33 N3 O3 S |
| Smiles: | CCC1=C(C(c2cc(C)ccc2C)N2C(CC(NC3CC4CCC3C4)=O)=CSC2=N1)C(=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5793 |
| logD: | 5.5725 |
| logSw: | -5.2896 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.405 |
| InChI Key: | SBDKYUYZZCGFHU-UHFFFAOYSA-N |