N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | D358-0668 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 405.43 |
| Molecular Formula: | C21 H15 N3 O4 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(C1=CN=C2N(C(=CS2)c2ccccc2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5127 |
| logD: | 2.5064 |
| logSw: | -2.986 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.773 |
| InChI Key: | GBMXRUOAGRZMIH-UHFFFAOYSA-N |