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475114-08-0 | 1H-Thieno[3,4-d]iMidazole-4-pentanaMide, N-(3-acetylphenyl)hexahydro-2-oxo-, (3aS,4S,6aR)-
CAS No: 475114-08-0 Catalog No: AG00E6TP MDL No:
Product Description
Catalog Number:
AG00E6TP
Chemical Name:
1H-Thieno[3,4-d]iMidazole-4-pentanaMide, N-(3-acetylphenyl)hexahydro-2-oxo-, (3aS,4S,6aR)-
CAS Number:
475114-08-0
IUPAC Name:
5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-(3-acetylphenyl)pentanamide
InChI:
InChI=1S/C18H23N3O3S/c1-11(22)12-5-4-6-13(9-12)19-16(23)8-3-2-7-15-17-14(10-25-15)20-18(24)21-17/h4-6,9,14-15,17H,2-3,7-8,10H2,1H3,(H,19,23)(H2,20,21,24)/t14-,15-,17-/m0/s1
InChI Key:
FKPQHDORXZXHJN-ZOBUZTSGSA-N
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
361.146g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
361.46g/mol
Monoisotopic Mass:
361.146g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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