Chemical ID: 6936710

CS(=O)CSc1c(cc2c(n1)CCCC2)C#N
Chemical ID:
6936710
Name [?]:
2-(methylsulfinylmethylsulfanyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
SMILES [?]:
CS(=O)CSc1c(cc2c(n1)CCCC2)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H14N2OS2
All Atoms:31
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.94412
Area:439.408
Solvation:-3.04107
Coulombic:-11.2861
Bond Count [?]
All:18
Single:13
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:266.384
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.83
LogP (Chemaxon):1.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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