N-[(3-bromophenyl)methyl]-7-oxo-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-7-oxo-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
N-[(3-bromophenyl)methyl]-7-oxo-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | F149-0971 |
| Compound Name: | N-[(3-bromophenyl)methyl]-7-oxo-2-(pyrrolidin-1-yl)-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-5-carboxamide |
| Molecular Weight: | 434.31 |
| Molecular Formula: | C17 H16 Br N5 O2 S |
| Smiles: | C1CCN(C1)C1=NN2C(=CC(N=C2S1)=O)C(NCc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7088 |
| logD: | 2.3573 |
| logSw: | -3.1468 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.793 |
| InChI Key: | PXINCZQBBSTTQN-UHFFFAOYSA-N |