N,N,9-trimethyl-2-[1-(2-nitrophenoxy)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Chemical Structure Depiction of
N,N,9-trimethyl-2-[1-(2-nitrophenoxy)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
N,N,9-trimethyl-2-[1-(2-nitrophenoxy)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Compound characteristics
| Compound ID: | Y502-7346 |
| Compound Name: | N,N,9-trimethyl-2-[1-(2-nitrophenoxy)ethyl]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide |
| Molecular Weight: | 426.45 |
| Molecular Formula: | C19 H18 N6 O4 S |
| Smiles: | CC(c1nc2c3c(C)c(C(N(C)C)=O)sc3ncn2n1)Oc1ccccc1[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5236 |
| logD: | 2.5191 |
| logSw: | -2.6845 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.076 |
| InChI Key: | ZZLFEXLZQWPOTQ-NSHDSACASA-N |