Chemical ID: 4104953

COc1ccc(cc1)N2C3CS(=O)(=O)CC3N(C2=S)c4ccc(cc4)F
Chemical ID:
4104953
Name [?]:
6-(4-fluorophenyl)-8-(4-methoxyphenyl)-3,3-dioxo-3$l^{6}-thia-6,8-diazabicyclo[3.3.0]octane-7-thione
SMILES [?]:
COc1ccc(cc1)N2C3CS(=O)(=O)CC3N(C2=S)c4ccc(cc4)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H17FN2O3S2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:2
ZAP Information [?]
Total:8.32818
Area:555.122
Solvation:-5.54986
Coulombic:-26.6457
Bond Count [?]
All:29
Single:20
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:392.47
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.1
LogP (Chemaxon):2.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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