Chemical ID: 4462128

CCCCSc1c(cc2c(n1)CCCC2)C#N
Chemical ID:
4462128
Name [?]:
2-butylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
SMILES [?]:
CCCCSc1c(cc2c(n1)CCCC2)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H18N2S
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:10.1837
Area:454.283
Solvation:-1.17342
Coulombic:-10.7512
Bond Count [?]
All:18
Single:14
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:246.372
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.53
LogP (Chemaxon):4.16

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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