Chemical ID: 6413864

COc1cccc(c1)C=NNC(=O)C(=O)Nc2cccc(c2)F
Chemical ID:
6413864
Name [?]:
N'-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyleneamino]oxamide
SMILES [?]:
COc1cccc(c1)C=NNC(=O)C(=O)Nc2cccc(c2)F
InChi [?]:
InChI=1/C16H14FN3O3/c1-23-14-7-2-4-11(8-14)10-18-20-16(22)15(21)19-13-6-3-5-12(17)9-13/h2-10H,1H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,5,19,6,20,18,4,8,22,9,7,21,17,3,14,12,23,10,16,11,15,13,2/rA:23nCOCCCCCCCNNCOCONCCCCCCF/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;w9;s10;s11;d12;s12;d14;s14;s16;s17;d18;s19;d20;d17s21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14FN3O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.02248
Area:513.639
Solvation:-4.81848
Coulombic:-54.9684
Bond Count [?]
All:24
Single:15
Double:9
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:315.299
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.1
LogP (Chemaxon):2.87

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