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475114-10-4 | 1H-Thieno[3,4-d]iMidazole-4-pentanaMide, N-(3-benzoylphenyl)hexahydro-2-oxo-, (3aS,4S,6aR)-
CAS No: 475114-10-4 Catalog No: AG00E6TR MDL No:
Product Description
Catalog Number:
AG00E6TR
Chemical Name:
1H-Thieno[3,4-d]iMidazole-4-pentanaMide, N-(3-benzoylphenyl)hexahydro-2-oxo-, (3aS,4S,6aR)-
CAS Number:
475114-10-4
IUPAC Name:
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-(3-benzoylphenyl)pentanamide
InChI:
InChI=1S/C23H25N3O3S/c27-20(12-5-4-11-19-21-18(14-30-19)25-23(29)26-21)24-17-10-6-9-16(13-17)22(28)15-7-2-1-3-8-15/h1-3,6-10,13,18-19,21H,4-5,11-12,14H2,(H,24,27)(H2,25,26,29)/t18-,19-,21-/m0/s1
InChI Key:
ZXMOMNSQJZFGIC-ZJOUEHCJSA-N
Properties
Complexity:
637
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
423.162g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
423.531g/mol
Monoisotopic Mass:
423.162g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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