200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 420099-20-3
420099-20-3 | N-(4-methylphenyl)-4-(pyridin-2-yl)piperazine-1-carbothioamide
CAS No: 420099-20-3 Catalog No: AG00IVCF MDL No:MFCD01962252
Product Description
Catalog Number:
AG00IVCF
Chemical Name:
N-(4-methylphenyl)-4-(pyridin-2-yl)piperazine-1-carbothioamide
CAS Number:
420099-20-3
Molecular Formula:
C17H20N4S
Molecular Weight:
312.4325
MDL Number:
MFCD01962252
IUPAC Name:
N-(4-methylphenyl)-4-pyridin-2-ylpiperazine-1-carbothioamide
InChI:
InChI=1S/C17H20N4S/c1-14-5-7-15(8-6-14)19-17(22)21-12-10-20(11-13-21)16-4-2-3-9-18-16/h2-9H,10-13H2,1H3,(H,19,22)
InChI Key:
JVCYTVWTHQBKRU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NC(=S)N1CCN(CC1)c1ccccn1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.141g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.435g/mol
Monoisotopic Mass:
312.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.