2-(3-methylpiperidin-1-yl)-7-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(3-methylpiperidin-1-yl)-7-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
2-(3-methylpiperidin-1-yl)-7-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F149-0777 |
| Compound Name: | 2-(3-methylpiperidin-1-yl)-7-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C22 H27 N5 O5 S |
| Smiles: | CC1CCCN(C1)C1=NN2C(=CC(N=C2S1)=O)C(NCc1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2686 |
| logD: | 2.2317 |
| logSw: | -2.8297 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.338 |
| InChI Key: | AHFUNTWXOGUTTN-ZDUSSCGKSA-N |