Chemical ID: 6647516

Cc1ccc(cc1Cl)NC(=O)C(=O)NN=Cc2ccccc2OCc3ccccc3
Chemical ID:
6647516
Name [?]:
N'-[(2-benzyloxyphenyl)methyleneamino]-N-(3-chloro-4-methyl-phenyl)-oxamide
SMILES [?]:
Cc1ccc(cc1Cl)NC(=O)C(=O)NN=Cc2ccccc2OCc3ccccc3
InChi [?]:
InChI=1/C23H20ClN3O3/c1-16-11-12-19(13-20(16)24)26-22(28)23(29)27-25-14-18-9-5-6-10-21(18)30-15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,26,28)(H,27,29)
InChi Info:
AuxInfo=1/1/N:1,28,27,29,19,20,26,30,18,21,3,4,6,16,24,2,25,17,5,7,22,10,12,8,15,9,14,11,13,23/E:(3,4)(7,8)/rA:30nCCCCCCCClNCOCONNCCCCCCCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s22;s23;s24;s25;d26;s27;d28;d25s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H20ClN3O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.6765
Area:667.559
Solvation:-4.0125
Coulombic:-54.7714
Bond Count [?]
All:32
Single:20
Double:12
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:421.876
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:5.5
LogP (Chemaxon):5.49

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