AC1NTNKH
ethyl 6-acetyl-3-cyano-7-[(N-methylanilino)methyl]-4H-pyrazolo[1,5-a]pyrimidine-7-carboxylate
Also Known As: ethyl 6-acetyl-3-cyano-7-[(N-methylanilino)methyl]-1H-pyrazo|ethyl 6-acetyl-3-cyano-7-[(N-methylanilino)methyl]-1H-pyrazolo[1,5-a]pyrimidine-7-carboxylate|ethyl 6-acetyl-3-cyano-7-[(N-methylanilino)methyl]-4H-pyrazolo[1,5-a]pyrimidine-7-carboxylate|Ethyl 6-acetyl-3-cyano-7-{[methyl(phenyl)amino]methyl}-1,7-dihydropyrazolo[1,5-a]pyrimidine-7-carboxylate
| Molecular Formula | C20H21N5O3 |
|---|---|
| Molecular Weight | 379.16443 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.16443 |
| Monoisotopic Mass | 379.16443 |
| Heavy Atoms | 28 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 79115-58-5 |
|---|---|
| SMILES | CCOC(=O)C1(C(=CNC2=C(C=NN21)C#N)C(=O)C)CN(C)C3=CC=CC=C3 |
| InChIKey | SSHXDBDLOUCAHK-UHFFFAOYSA-N |
Product Overview
AC1NTNKH (CAS 79115-58-5), with molecular formula C20H21N5O3 and molecular weight 379.16443 g/mol. IUPAC: ethyl 6-acetyl-3-cyano-7-[(N-methylanilino)methyl]-4H-pyrazolo[1,5-a]pyrimidine-7-carboxylate.
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