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606089-87-6 | 1-Piperidinecarbothioamide,3-(1H-benzimidazol-2-yl)-N-(2,3-dimethylphenyl)-(9CI)
CAS No: 606089-87-6 Catalog No: AG00F8FA MDL No:
Product Description
Catalog Number:
AG00F8FA
Chemical Name:
1-Piperidinecarbothioamide,3-(1H-benzimidazol-2-yl)-N-(2,3-dimethylphenyl)-(9CI)
CAS Number:
606089-87-6
IUPAC Name:
3-(1H-benzimidazol-2-yl)-N-(2,3-dimethylphenyl)piperidine-1-carbothioamide
InChI:
InChI=1S/C21H24N4S/c1-14-7-5-11-17(15(14)2)24-21(26)25-12-6-8-16(13-25)20-22-18-9-3-4-10-19(18)23-20/h3-5,7,9-11,16H,6,8,12-13H2,1-2H3,(H,22,23)(H,24,26)
InChI Key:
FBKHKUJYBJMIJC-UHFFFAOYSA-N
Properties
Complexity:
498
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.172g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
364.511g/mol
Monoisotopic Mass:
364.172g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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