Chemical ID: 6392970

COc1cccc(c1O)C=NNC(=O)c2cccc3c2cccc3
Chemical ID:
6392970
Name [?]:
N-[(2-hydroxy-3-methoxy-phenyl)methyleneamino]naphthalene-1-carboxamide
SMILES [?]:
COc1cccc(c1O)C=NNC(=O)c2cccc3c2cccc3
InChi [?]:
InChI=1/C19H16N2O3/c1-24-17-11-5-8-14(18(17)22)12-20-21-19(23)16-10-4-7-13-6-2-3-9-15(13)16/h2-12,22H,1H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,23,22,17,5,24,18,6,21,16,4,10,19,7,20,15,3,8,13,11,12,9,14,2/rA:24nCOCCCCCCOCNNCOCCCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s7;w10;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s20;d21;s22;s19d23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16N2O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:7.44451
Area:510.068
Solvation:-5.30719
Coulombic:-44.6761
Bond Count [?]
All:26
Single:16
Double:10
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:320.342
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.77
LogP (Chemaxon):3.71

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