Chemical ID: 6422706

c1cc(sc1)c2c[nH]nc2
Chemical ID:
6422706
Name [?]:
4-(2-thienyl)-1H-pyrazole
SMILES [?]:
c1cc(sc1)c2c[nH]nc2
InChi [?]:
InChI=1/C7H6N2S/c1-2-7(10-3-1)6-4-8-9-5-6/h1-5H,(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,2,5,7,10,6,3,8,9,4/E:(4,5)(8,9)/rA:10nCCCSCCCNNC/rB:s1;d2;s3;d1s4;s3;d6;s7;s8;s6d9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H6N2S
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.82659
Area:302.308
Solvation:-1.73112
Coulombic:-9.7582
Bond Count [?]
All:11
Single:7
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:150.202
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.68
LogP (Chemaxon):1.47

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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