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Home > Other Heterocycles > 1706450-52-3
1706450-52-3 | 3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-8-azabicyclo[3.2.1]octane
CAS No: 1706450-52-3 Catalog No: AG01APF1 MDL No:MFCD29034707
Product Description
Catalog Number:
AG01APF1
Chemical Name:
3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-8-azabicyclo[3.2.1]octane
CAS Number:
1706450-52-3
MDL Number:
MFCD29034707
IUPAC Name:
3-[(4-methyl-1,2,4-triazol-3-yl)sulfonyl]-8-azabicyclo[3.2.1]octane
InChI:
InChI=1S/C10H16N4O2S/c1-14-6-11-13-10(14)17(15,16)9-4-7-2-3-8(5-9)12-7/h6-9,12H,2-5H2,1H3
InChI Key:
WURYBDBOQAYFRX-UHFFFAOYSA-N
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.099g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.324g/mol
Monoisotopic Mass:
256.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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