Chemical ID: 6630017

Cc1ccccc1NC(=O)C(=O)NN=Cc2ccc(cc2)OCc3ccc(cc3)Cl
Chemical ID:
6630017
Name [?]:
N'-[[4-[(4-chlorophenyl)methoxy]phenyl]methyleneamino]-N-(o-tolyl)oxamide
SMILES [?]:
Cc1ccccc1NC(=O)C(=O)NN=Cc2ccc(cc2)OCc3ccc(cc3)Cl
InChi [?]:
InChI=1/C23H20ClN3O3/c1-16-4-2-3-5-21(16)26-22(28)23(29)27-25-14-17-8-12-20(13-9-17)30-15-18-6-10-19(24)11-7-18/h2-14H,15H2,1H3,(H,26,28)(H,27,29)
InChi Info:
AuxInfo=1/1/N:1,4,5,3,6,25,29,17,21,26,28,18,20,15,23,2,16,24,27,19,7,9,11,30,14,8,13,10,12,22/E:(6,7)(8,9)(10,11)(12,13)/rA:30nCCCCCCCNCOCONNCCCCCCCOCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;d11;s11;s13;w14;s15;s16;d17;s18;d19;d16s20;s19;s22;s23;s24;d25;s26;d27;d24s28;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H20ClN3O3
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.5929
Area:675.791
Solvation:-4.30189
Coulombic:-54.1452
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):4.84

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