N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | D358-0944 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-methylphenyl)-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 419.46 |
| Molecular Formula: | C22 H17 N3 O4 S |
| Smiles: | Cc1ccc(cc1)C1=CSC2=NC=C(C(NCc3ccc4c(c3)OCO4)=O)C(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0411 |
| logD: | 3.0348 |
| logSw: | -3.2891 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.773 |
| InChI Key: | UCKRQZFWHQQNMM-UHFFFAOYSA-N |