N,N-diethyl-9-methyl-2-(2-nitrophenyl)thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Chemical Structure Depiction of
N,N-diethyl-9-methyl-2-(2-nitrophenyl)thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
N,N-diethyl-9-methyl-2-(2-nitrophenyl)thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Compound characteristics
| Compound ID: | Y502-3888 |
| Compound Name: | N,N-diethyl-9-methyl-2-(2-nitrophenyl)thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide |
| Molecular Weight: | 410.45 |
| Molecular Formula: | C19 H18 N6 O3 S |
| Smiles: | CCN(CC)C(c1c(C)c2c3nc(c4ccccc4[N+]([O-])=O)nn3cnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0095 |
| logD: | 3.0011 |
| logSw: | -3.7276 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 80.132 |
| InChI Key: | BXIVBTSGNNEIOD-UHFFFAOYSA-N |