Chemical ID: 6436602

Cc1ccc2c(c1)c(c(o2)C(=O)Nc3ccc(cc3)NC(=O)C)C
Chemical ID:
6436602
Name [?]:
N-(4-acetamidophenyl)-3,5-dimethyl-benzofuran-2-carboxamide
SMILES [?]:
Cc1ccc2c(c1)c(c(o2)C(=O)Nc3ccc(cc3)NC(=O)C)C
InChi [?]:
InChI=1/C19H18N2O3/c1-11-4-9-17-16(10-11)12(2)18(24-17)19(23)21-15-7-5-14(6-8-15)20-13(3)22/h4-10H,1-3H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,24,23,3,16,18,15,19,4,7,2,8,21,17,14,6,5,9,11,20,13,22,12,10/E:(5,6)(7,8)/rA:24nCCCCCCCCCOCONCCCCCCNCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s5s9;s9;d11;s11;s13;s14;d15;s16;d17;d14s18;s17;s20;d21;s21;s8;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.1987
Area:535.948
Solvation:-3.20001
Coulombic:-50.1306
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:322.358
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.46
LogP (Chemaxon):3.71

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Descriptor Annotations

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