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835654-31-4 | Thiazole, 2-[1-(1-pyrrolidinyl)cyclohexyl]-
CAS No: 835654-31-4 Catalog No: AG008IXO MDL No:
Product Description
Catalog Number:
AG008IXO
Chemical Name:
Thiazole, 2-[1-(1-pyrrolidinyl)cyclohexyl]-
CAS Number:
835654-31-4
Molecular Formula:
C13H20N2S
Molecular Weight:
236.3763
IUPAC Name:
2-(1-pyrrolidin-1-ylcyclohexyl)-1,3-thiazole
InChI:
InChI=1S/C13H20N2S/c1-2-6-13(7-3-1,12-14-8-11-16-12)15-9-4-5-10-15/h8,11H,1-7,9-10H2
InChI Key:
RDFMCACPYBFCGM-UHFFFAOYSA-N
SMILES:
C1CCC(CC1)(N1CCCC1)c1nccs1
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.135g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.377g/mol
Monoisotopic Mass:
236.135g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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