200,000+ products from a single source!
sales@angenechem.com
89652-00-6 | 1-Piperidinecarbothioamide, N-phenyl-2-(3-pyridinyl)-, (S)-
CAS No: 89652-00-6 Catalog No: AG00465Y MDL No:
Product Description
Catalog Number:
AG00465Y
Chemical Name:
1-Piperidinecarbothioamide, N-phenyl-2-(3-pyridinyl)-, (S)-
CAS Number:
89652-00-6
Molecular Formula:
C17H19N3S
Molecular Weight:
297.4179
IUPAC Name:
(2S)-N-phenyl-2-pyridin-3-ylpiperidine-1-carbothioamide
InChI:
InChI=1S/C17H19N3S/c21-17(19-15-8-2-1-3-9-15)20-12-5-4-10-16(20)14-7-6-11-18-13-14/h1-3,6-9,11,13,16H,4-5,10,12H2,(H,19,21)/t16-/m0/s1
InChI Key:
IYRYZPHOBLEAJX-INIZCTEOSA-N
SMILES:
S=C(N1CCCC[C@H]1c1cccnc1)Nc1ccccc1
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
297.13g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.42g/mol
Monoisotopic Mass:
297.13g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
© 2019 Angene International Limited. All rights Reserved.