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Home > Other Heterocycles > 174823-41-7
174823-41-7 | 2,5-Diazabicyclo[2.2.1]heptane, 2-methyl-5-pyrazinyl-, (1S)- (9CI)
CAS No: 174823-41-7 Catalog No: AG001ZZN MDL No:
Product Description
Catalog Number:
AG001ZZN
Chemical Name:
2,5-Diazabicyclo[2.2.1]heptane, 2-methyl-5-pyrazinyl-, (1S)- (9CI)
CAS Number:
174823-41-7
Molecular Formula:
C10H14N4
Molecular Weight:
190.2450
IUPAC Name:
(1S,4S)-2-methyl-5-pyrazin-2-yl-2,5-diazabicyclo[2.2.1]heptane
InChI:
InChI=1S/C10H14N4/c1-13-6-9-4-8(13)7-14(9)10-5-11-2-3-12-10/h2-3,5,8-9H,4,6-7H2,1H3/t8-,9-/m0/s1
InChI Key:
JCLKFAIMNYLWLP-IUCAKERBSA-N
SMILES:
CN1CC2C[C@H]1CN2c1cnccn1
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
190.122g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.25g/mol
Monoisotopic Mass:
190.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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