AC1NPWRD
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-naphthalen-2-ylsulfonyl-1,4-diazepane
Also Known As: KS-00003PEA|MS-7396|1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-(naphthalene-2-sulfonyl)-1,4-diazepane|1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-naphthalen-2-ylsulfonyl-1,4-diazepane|1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-(2-naphthylsulfonyl)-1,4-diazepane|1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(2-naphthylsulfonyl)-1,4-diazepane|4-(3-Chloro-5-(trifluoromethyl)(2-pyridyl))-1-(2-naphthylsulfonyl)-1,4-diazaperhydroepine
| Molecular Formula | C21H19ClF3N3O2S |
|---|---|
| Molecular Weight | 469.08386 g/mol |
| LogP | 4.808 |
| Topological Polar Surface Area | 53.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 469.08386 |
| Monoisotopic Mass | 469.08386 |
| Heavy Atoms | 31 |
| Complexity | 1217.9607 |
Chemical Identifiers
| CAS Number | 1024482-77-6 |
|---|---|
| SMILES | C1CN(CCN(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
AC1NPWRD (CAS 1024482-77-6), with molecular formula C21H19ClF3N3O2S and molecular weight 469.08386 g/mol. IUPAC: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-4-naphthalen-2-ylsulfonyl-1,4-diazepane.
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