AC1N54ZY
N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: AK-968/41923745|N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide|N-{3-[(4-chloroanilino)carbonyl]-4,5,6,7-tetrahydro-1-benzothien-2-yl}-5-(5-ethyl-2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide|N-(4-chlorophenyl)(2-{[5-(5-ethyl(2-thienyl))-7-(trifluoromethyl)(8-hydropyraz olo[1,5-a]pyrimidin-2-yl)]carbonylamino}(4,5,6,7-tetrahydrobenzo[b]thiophen-3- yl))carboxamide|N-{3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C29H23ClF3N5O2S2 |
|---|---|
| Molecular Weight | 629.0934 g/mol |
| LogP | 8.1373 |
| Topological Polar Surface Area | 88.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 629.0934 |
| Monoisotopic Mass | 629.0934 |
| Heavy Atoms | 42 |
| Complexity | 1825.3319 |
Chemical Identifiers
| CAS Number | 438237-34-4 |
|---|---|
| SMILES | CCC1=CC=C(S1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)NC6=CC=C(C=C6)Cl |
Product Overview
AC1N54ZY (CAS 438237-34-4), with molecular formula C29H23ClF3N5O2S2 and molecular weight 629.0934 g/mol. IUPAC: N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.