Chemical ID: 3995675

c1ccc2c(c1)NCCS2
Chemical ID:
3995675
Name [?]:
2-thia-5-azabicyclo[4.4.0]deca-7,9,11-triene
SMILES [?]:
c1ccc2c(c1)NCCS2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H9NS
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.37971
Area:292.477
Solvation:-0.932217
Coulombic:-13.5785
Bond Count [?]
All:11
Single:8
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:151.23
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.14
LogP (Chemaxon):1.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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