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Home > Pyridines > 140934-80-1
140934-80-1 | 1-cyclohexyl-3-[(pyridin-4-yl)methyl]thiourea
CAS No: 140934-80-1 Catalog No: AG00J06V MDL No:MFCD02639676
Product Description
Catalog Number:
AG00J06V
Chemical Name:
1-cyclohexyl-3-[(pyridin-4-yl)methyl]thiourea
CAS Number:
140934-80-1
Molecular Formula:
C13H19N3S
Molecular Weight:
249.3751
MDL Number:
MFCD02639676
IUPAC Name:
1-cyclohexyl-3-(pyridin-4-ylmethyl)thiourea
InChI:
InChI=1S/C13H19N3S/c17-13(16-12-4-2-1-3-5-12)15-10-11-6-8-14-9-7-11/h6-9,12H,1-5,10H2,(H2,15,16,17)
InChI Key:
ACLJMUOWEWLOJO-UHFFFAOYSA-N
SMILES:
S=C(NC1CCCCC1)NCc1ccncc1
Properties
Complexity:
233
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:
69A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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