Chemical ID: 4107923

c1ccc2c(c1)nc(s2)OCC(=O)N3c4ccccc4Sc5c3cc(cc5)C(F)(F)F
Chemical ID:
4107923
Name [?]:
2-benzothiazol-2-yloxy-1-[2-(trifluoromethyl)phenothiazin-10-yl]-ethanone
SMILES [?]:
c1ccc2c(c1)nc(s2)OCC(=O)N3c4ccccc4Sc5c3cc(cc5)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H13F3N2O2S2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:10.6461
Area:592.329
Solvation:-4.16212
Coulombic:-52.012
Bond Count [?]
All:35
Single:24
Double:11
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:458.478
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:5.39
LogP (Chemaxon):6.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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