Chemical ID: 4760990

Cc1c(c(n(n1)CC(=O)NN)C)Br
Chemical ID:
4760990
Name [?]:
2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)acetohydrazide
SMILES [?]:
Cc1c(c(n(n1)CC(=O)NN)C)Br
InChi [?]:
InChI=1/C7H11BrN4O/c1-4-7(8)5(2)12(11-4)3-6(13)10-9/h3,9H2,1-2H3,(H,10,13)
InChi Info:
AuxInfo=1/1/N:1,12,7,2,4,8,3,13,11,10,6,5,9/rA:13nCCCCNNCCONNCBr/rB:s1;s2;d3;s4;d2s5;s5;s7;d8;s8;s10;s4;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H11BrN4O
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.47631
Area:366.766
Solvation:-3.69285
Coulombic:-29.4786
Bond Count [?]
All:13
Single:10
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:247.093
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:-0.13
LogP (Chemaxon):-0.04

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Descriptor Annotations

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