Chemical ID: 6631363

Cc1ccc(cc1Cl)NC(=O)C(=O)NN=Cc2ccccc2Br
Chemical ID:
6631363
Name [?]:
N'-[(2-bromophenyl)methyleneamino]-N-(3-chloro-4-methyl-phenyl)-oxamide
SMILES [?]:
Cc1ccc(cc1Cl)NC(=O)C(=O)NN=Cc2ccccc2Br
InChi [?]:
InChI=1/C16H13BrClN3O2/c1-10-6-7-12(8-14(10)18)20-15(22)16(23)21-19-9-11-4-2-3-5-13(11)17/h2-9H,1H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,19,20,18,21,3,4,6,16,2,17,5,22,7,10,12,23,8,15,9,14,11,13/rA:23nCCCCCCCClNCOCONNCCCCCCCBr/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H13BrClN3O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.1369
Area:545.128
Solvation:-2.49125
Coulombic:-45.7406
Bond Count [?]
All:24
Single:15
Double:9
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:394.65
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.67
LogP (Chemaxon):4.76

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