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1781675-07-7 | 3,5,6,7-tetrahydrospiro[imidazo[4,5-c]pyridine-4,4'-thiane]
CAS No: 1781675-07-7 Catalog No: AG01BXZO MDL No:MFCD30202902
Product Description
Catalog Number:
AG01BXZO
Chemical Name:
3,5,6,7-tetrahydrospiro[imidazo[4,5-c]pyridine-4,4'-thiane]
CAS Number:
1781675-07-7
Molecular Formula:
C10H15N3S
Molecular Weight:
209.3112
MDL Number:
MFCD30202902
IUPAC Name:
spiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridine-4,4'-thiane]
InChI:
InChI=1S/C10H15N3S/c1-4-13-10(2-5-14-6-3-10)9-8(1)11-7-12-9/h7,13H,1-6H2,(H,11,12)
InChI Key:
AIQPPUSMQAKALG-UHFFFAOYSA-N
SMILES:
S1CCC2(CC1)NCCc1c2[nH]cn1
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.311g/mol
Monoisotopic Mass:
209.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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