Chemical ID: 4684385

c1ccc2c(c1)c(cc(n2)c3ccc(c(c3)Cl)Cl)C(=O)NN
Chemical ID:
4684385
Name [?]:
2-(3,4-dichlorophenyl)quinoline-4-carbohydrazide
SMILES [?]:
c1ccc2c(c1)c(cc(n2)c3ccc(c(c3)Cl)Cl)C(=O)NN
InChi [?]:
InChI=1/C16H11Cl2N3O/c17-12-6-5-9(7-13(12)18)15-8-11(16(22)21-19)10-3-1-2-4-14(10)20-15/h1-8H,19H2,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,12,13,16,8,11,5,7,14,15,4,9,19,18,17,22,10,21,20/rA:22nCCCCCCCCCNCCCCCCClClCONN/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s9;s11;d12;s13;d14;d11s15;s15;s14;s7;d19;s19;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H11Cl2N3O
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.89847
Area:514.121
Solvation:-2.95455
Coulombic:-35.4028
Bond Count [?]
All:24
Single:15
Double:9
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:332.184
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:3.81
LogP (Chemaxon):3.89

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Descriptor Annotations

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