Chemical ID: 4736796

c1cc(sc1)c2cc[nH]n2
Chemical ID:
4736796
Name [?]:
3-(2-thienyl)-1H-pyrazole
SMILES [?]:
c1cc(sc1)c2cc[nH]n2
InChi [?]:
InChI=1/C7H6N2S/c1-2-7(10-5-1)6-3-4-8-9-6/h1-5H,(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,2,7,8,5,6,3,9,10,4/rA:10nCCCSCCCCNN/rB:s1;d2;s3;d1s4;s3;s6;d7;s8;d6s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H6N2S
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:6.06234
Area:302.625
Solvation:-1.50329
Coulombic:-10.6
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):1.87

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Descriptor Annotations

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