Chemical ID: 4718296

c1ccc2c(c1)nc(s2)N3CCN(CC3)Cc4c(cccc4Cl)F
Chemical ID:
4718296
Name [?]:
2-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]benzothiazole
SMILES [?]:
c1ccc2c(c1)nc(s2)N3CCN(CC3)Cc4c(cccc4Cl)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H17ClFN3S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.6906
Area:533.758
Solvation:-2.65335
Coulombic:-24.4444
Bond Count [?]
All:27
Single:20
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:361.865
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.28
LogP (Chemaxon):5.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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