Chemical ID: 4574796

CN(Cc1cc2cc(ccc2nc1O)OC)C(=O)c3ccccc3
Chemical ID:
4574796
Name [?]:
N-[(2-hydroxy-6-methoxy-3-quinolyl)methyl]-N-methyl-benzamide
SMILES [?]:
CN(Cc1cc2cc(ccc2nc1O)OC)C(=O)c3ccccc3
InChi [?]:
InChI=1/C19H18N2O3/c1-21(19(23)13-6-4-3-5-7-13)12-15-10-14-11-16(24-2)8-9-17(14)20-18(15)22/h3-11H,12H2,1-2H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,16,22,21,23,20,24,9,10,5,7,3,19,6,4,8,11,13,17,12,2,14,18,15/E:(4,5)(6,7)/rA:24nCNCCCCCCCCCNCOOCCOCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;s8;d9;s6s10;d11;d4s12;s13;s8;s15;s2;d17;s17;s19;d20;s21;d22;d19s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.70967
Area:514.638
Solvation:-4.15629
Coulombic:-48.1205
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:322.358
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.62
LogP (Chemaxon):3.22

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Descriptor Annotations

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