Chemical ID: 5345945

COc1ccc(cc1N)NC(=O)c2ccc(o2)CO
Chemical ID:
5345945
Name [?]:
N-(3-amino-4-methoxy-phenyl)-5-(hydroxymethyl)furan-2-carboxamide
SMILES [?]:
COc1ccc(cc1N)NC(=O)c2ccc(o2)CO
InChi [?]:
InChI=1/C13H14N2O4/c1-18-11-4-2-8(6-10(11)14)15-13(17)12-5-3-9(7-16)19-12/h2-6,16H,7,14H2,1H3,(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,5,15,4,14,7,18,6,16,8,3,13,11,9,10,19,12,2,17/rA:19nCOCCCCCCNNCOCCCCOCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s6;s10;d11;s11;d13;s14;d15;s13s16;s16;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H14N2O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:6.46199
Area:459.344
Solvation:-5.02162
Coulombic:-69.6302
Bond Count [?]
All:20
Single:14
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:262.261
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:-0.01
LogP (Chemaxon):0.24

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