N-[(4-bromophenyl)methyl]-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
N-[(4-bromophenyl)methyl]-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide
Compound characteristics
| Compound ID: | C200-7859 |
| Compound Name: | N-[(4-bromophenyl)methyl]-3-(5-oxo-4-propyl-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)propanamide |
| Molecular Weight: | 474.38 |
| Molecular Formula: | C20 H20 Br N5 O2 S |
| Smiles: | CCCN1C(c2c(ccs2)n2c(CCC(NCc3ccc(cc3)[Br])=O)nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1333 |
| logD: | 3.1333 |
| logSw: | -3.2927 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.446 |
| InChI Key: | NRQUFMBCLLKKEP-UHFFFAOYSA-N |