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66561-97-5 | 1H-Thieno[3,4-d)imidazole-4-pentanamide, N, N-bis[2-(diphenylphosphino )ethyl]hexahydro-2-oxo-, (3a.alpha., 4.beta.,6a.alpha.)-
CAS No: 66561-97-5 Catalog No: AG00FSGU MDL No:
Product Description
Catalog Number:
AG00FSGU
Chemical Name:
1H-Thieno[3,4-d)imidazole-4-pentanamide, N, N-bis[2-(diphenylphosphino )ethyl]hexahydro-2-oxo-, (3a.alpha., 4.beta.,6a.alpha.)-
CAS Number:
66561-97-5
IUPAC Name:
N,N-bis(2-diphenylphosphanylethyl)-5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanamide
InChI:
InChI=1S/C38H43N3O2P2S/c42-36(24-14-13-23-35-37-34(29-46-35)39-38(43)40-37)41(25-27-44(30-15-5-1-6-16-30)31-17-7-2-8-18-31)26-28-45(32-19-9-3-10-20-32)33-21-11-4-12-22-33/h1-12,15-22,34-35,37H,13-14,23-29H2,(H2,39,40,43)
InChI Key:
YQGVXWZSNIQEOR-UHFFFAOYSA-N
Properties
Complexity:
853
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
667.255g/mol
Formal Charge:
0
Heavy Atom Count:
46
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
667.789g/mol
Monoisotopic Mass:
667.255g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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