N-[(3-ethoxy-4-methoxyphenyl)methyl]-2-(morpholin-4-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(3-ethoxy-4-methoxyphenyl)methyl]-2-(morpholin-4-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
N-[(3-ethoxy-4-methoxyphenyl)methyl]-2-(morpholin-4-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F149-0454 |
| Compound Name: | N-[(3-ethoxy-4-methoxyphenyl)methyl]-2-(morpholin-4-yl)-7-oxo-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide |
| Molecular Weight: | 445.5 |
| Molecular Formula: | C20 H23 N5 O5 S |
| Smiles: | CCOc1cc(CNC(C2=CC(N=C3N2N=C(N2CCOCC2)S3)=O)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 0.85 |
| logD: | 0.8077 |
| logSw: | -2.4123 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.176 |
| InChI Key: | JPSUUYOJQSNGLN-UHFFFAOYSA-N |