Home Other Building Blocks (1-benzylpiperidin-4-yl)thiourea

(1-benzylpiperidin-4-yl)thiourea

CAS No.:
196199-56-1
Catalog Number:
AG019XG3
Molecular Formula:
C13H19N3S
Molecular Weight:
249.3751
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Product Description
Catalog Number:
AG019XG3
Chemical Name:
(1-benzylpiperidin-4-yl)thiourea
CAS Number:
196199-56-1
Molecular Formula:
C13H19N3S
Molecular Weight:
249.3751
MDL Number:
MFCD10693875
IUPAC Name:
(1-benzylpiperidin-4-yl)thiourea
InChI:
InChI=1S/C13H19N3S/c14-13(17)15-12-6-8-16(9-7-12)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H3,14,15,17)
InChI Key:
XAKQWJCBJYLSBD-UHFFFAOYSA-N
SMILES:
NC(=S)NC1CCN(CC1)Cc1ccccc1
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.13g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.376g/mol
Monoisotopic Mass:
249.13g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties