2-(1'-(tert-Butoxycarbonyl)-6-fluoro-2,3-dihydrospiro[indene-1,4'-piperidine]-3-yl)acetic Acid - CAS 1160247-55-1
Catalog: |
BB070909 |
Product Name: |
2-(1'-(tert-Butoxycarbonyl)-6-fluoro-2,3-dihydrospiro[indene-1,4'-piperidine]-3-yl)acetic Acid |
CAS: |
1160247-55-1 |
Synonyms: |
2-(1'-(tert-Butoxycarbonyl)-6-fluoro-2,3-dihydrospiro[indene-1,4'-piperidin]-3-yl)acetic acid; 2-[5-fluoro-1'-[(2-methylpropan-2-yl)oxycarbonyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetic acid; 2-(1'-(Tert-butoxycarbonyl)-6-fluoro-2,3-dihydrospiro[indene-1,4'-piperidine]-3-yl)acetic acid; 2-(1-(Tert-Butoxycarbonyl)-6-Fluoro-2,3-Dihydrospiro[Indene-1,4-Piperidine]-3-Yl)Acetic Acid |
IUPAC Name: | 2-[5-fluoro-1'-[(2-methylpropan-2-yl)oxycarbonyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetic acid |
Molecular Weight: | 363.42 |
Molecular Formula: | C20H26NO4F |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2(CC1)CC(C3=C2C=C(C=C3)F)CC(=O)O |
InChI: | InChI=1S/C20H26FNO4/c1-19(2,3)26-18(25)22-8-6-20(7-9-22)12-13(10-17(23)24)15-5-4-14(21)11-16(15)20/h4-5,11,13H,6-10,12H2,1-3H3,(H,23,24) |
InChI Key: | AWICMJBHPMLOFP-UHFFFAOYSA-N |
Complexity: | 551 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 363.18458647 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 363.18458647 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 66.8Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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