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53906-36-8 | 1H-Thieno[3,4-d]imidazol-2(3H)-one, tetrahydro-4-(5-hydroxypentyl)-,(3aS,4S,6aR)-
CAS No: 53906-36-8 Catalog No: AG00I9MC MDL No:MFCD30532025
Product Description
Catalog Number:
AG00I9MC
Chemical Name:
1H-Thieno[3,4-d]imidazol-2(3H)-one, tetrahydro-4-(5-hydroxypentyl)-,(3aS,4S,6aR)-
CAS Number:
53906-36-8
MDL Number:
MFCD30532025
IUPAC Name:
(3aS,4S,6aR)-4-(5-hydroxypentyl)-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-2-one
InChI:
InChI=1S/C10H18N2O2S/c13-5-3-1-2-4-8-9-7(6-15-8)11-10(14)12-9/h7-9,13H,1-6H2,(H2,11,12,14)/t7-,8-,9-/m0/s1
InChI Key:
RGIKRHKHRAAZIO-CIUDSAMLSA-N
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
230.109g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
230.326g/mol
Monoisotopic Mass:
230.109g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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