Chemical ID: 6421448

c1cnc(cc1C(=O)N)Br
Chemical ID:
6421448
Name [?]:
2-bromopyridine-4-carboxamide
SMILES [?]:
c1cnc(cc1C(=O)N)Br
InChi [?]:
InChI=1/C6H5BrN2O/c7-5-3-4(6(8)10)1-2-9-5/h1-3H,(H2,8,10)
InChi Info:
AuxInfo=1/1/N:1,2,5,6,4,7,10,9,3,8/rA:10nCCNCCCCONBr/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s4;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H5BrN2O
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.53877
Area:302.68
Solvation:-2.02822
Coulombic:-30.309
Bond Count [?]
All:10
Single:6
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:201.021
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:0.54
LogP (Chemaxon):0.58

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Descriptor Annotations

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