Chemical ID: 4709269

c1ccc2c(c1)c(n[nH]2)n3cccc3
Chemical ID:
4709269
Name [?]:
3-pyrrol-1-yl-1H-indazole
SMILES [?]:
c1ccc2c(c1)c(n[nH]2)n3cccc3
InChi [?]:
InChI=1/C11H9N3/c1-2-6-10-9(5-1)11(13-12-10)14-7-3-4-8-14/h1-8H,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,12,13,6,3,11,14,5,4,7,9,8,10/E:(3,4)(7,8)/rA:14nCCCCCCCNNNCCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s7;s10;d11;s12;s10d13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H9N3
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.73263
Area:343.834
Solvation:-1.86322
Coulombic:-17.2455
Bond Count [?]
All:16
Single:10
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:183.209
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.14
LogP (Chemaxon):3.13

Name Annotations

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Descriptor Annotations

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