Chemical ID: 6916885

c1cc(ccc1C2(SCCS2)CCCN3CCC(CC3)(c4ccc(cc4)Cl)O)F
Chemical ID:
6916885
Name [?]:
4-(4-chlorophenyl)-1-[3-[2-(4-fluorophenyl)-1,3-dithiolan-2-yl]propyl]piperidin-4-ol
SMILES [?]:
c1cc(ccc1C2(SCCS2)CCCN3CCC(CC3)(c4ccc(cc4)Cl)O)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H27ClFNOS2
All Atoms:56
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.945
Area:657.997
Solvation:-3.50495
Coulombic:-31.4374
Bond Count [?]
All:32
Single:26
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:452.05
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.39
LogP (Chemaxon):5.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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