AC1O1BVV
5-(4-bromophenyl)-N-[3-(5-methyl-2-propan-2-ylphenoxy)-5-nitrophenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: AK-968/41026113|5-(4-Bromophenyl)-4,5,6,7-tetrahydro-N-[3-[5-methyl-2-(1-methylethyl)phenoxy]-5-nitrophenyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide|5-(4-bromophenyl)-N-[3-nitro-5-(2-isopropyl-5-methylphenoxy)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide|5-(4-Bromophenyl)-4,5,6,7-tetrahydro-N-(3-(5-methyl-2-(1-methylethyl)phenoxy)-5-nitrophenyl)-7-(trifluoromethyl)pyrazolo(1,5-a)pyrimidine-2-carboxamide|5-(4-bromophenyl)-N-[3-(5-methyl-2-propan-2-ylphenoxy)-5-nitrophenyl]-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide|5-(4-bromophenyl)-N-[3-(5-methyl-2-propan-2-ylphenoxy)-5-nitrophenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide|5-(4-BROMOPHENYL)-N~2~-[3-(2-ISOPROPYL-5-METHYLPHENOXY)-5-NITROPHENYL]-7-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXAMIDE
| Molecular Formula | C30H27BrF3N5O4 |
|---|---|
| Molecular Weight | 657.1199 g/mol |
| LogP | 8.69052 |
| Topological Polar Surface Area | 111.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 657.1199 |
| Monoisotopic Mass | 657.1199 |
| Heavy Atoms | 43 |
| Complexity | 1688.2957 |
Chemical Identifiers
| CAS Number | 438532-75-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN4C(CC(NC4=C3)C5=CC=C(C=C5)Br)C(F)(F)F |
Product Overview
AC1O1BVV (CAS 438532-75-3), with molecular formula C30H27BrF3N5O4 and molecular weight 657.1199 g/mol. IUPAC: 5-(4-bromophenyl)-N-[3-(5-methyl-2-propan-2-ylphenoxy)-5-nitrophenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide.