N,N,9-trimethyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Chemical Structure Depiction of
N,N,9-trimethyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
N,N,9-trimethyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Compound characteristics
| Compound ID: | Y502-7347 |
| Compound Name: | N,N,9-trimethyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide |
| Molecular Weight: | 400.42 |
| Molecular Formula: | C16 H16 N8 O3 S |
| Smiles: | Cc1c2c3nc(CCn4cc(cn4)[N+]([O-])=O)nn3cnc2sc1C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6694 |
| logD: | 0.6654 |
| logSw: | -1.5676 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 96.247 |
| InChI Key: | HJDLLTYRPDRKDZ-UHFFFAOYSA-N |