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24898-62-2 | N2-[(Isoquinolin-1-yl)methylene]-1-pyrrolidinecarbothiohydrazide
CAS No: 24898-62-2 Catalog No: AG00CCZS MDL No:
Product Description
Catalog Number:
AG00CCZS
Chemical Name:
N2-[(Isoquinolin-1-yl)methylene]-1-pyrrolidinecarbothiohydrazide
CAS Number:
24898-62-2
IUPAC Name:
N-[(Z)-isoquinolin-1-ylmethylideneamino]pyrrolidine-1-carbothioamide
InChI:
InChI=1S/C15H16N4S/c20-15(19-9-3-4-10-19)18-17-11-14-13-6-2-1-5-12(13)7-8-16-14/h1-2,5-8,11H,3-4,9-10H2,(H,18,20)/b17-11-
InChI Key:
BIPHDBGCGJSQGC-BOPFTXTBSA-N
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
284.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.381g/mol
Monoisotopic Mass:
284.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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