N-[(5-bromo-2-methoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(5-bromo-2-methoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G205-0974 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-5-oxo-2-(pyrrolidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 464.34 |
| Molecular Formula: | C18 H18 Br N5 O3 S |
| Smiles: | COc1ccc(cc1CNC(C1=CN=C2N(C1=O)N=C(N1CCCC1)S2)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.662 |
| logD: | 2.5381 |
| logSw: | -3.0707 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.236 |
| InChI Key: | KFEGQRNJJQEPOD-UHFFFAOYSA-N |