Chemical ID: 4246376

Cc1cc2c(c(oc2cc1C)C(=O)NCc3ccc(cc3)OC)C
Chemical ID:
4246376
Name [?]:
N-[(4-methoxyphenyl)methyl]-3,5,6-trimethyl-benzofuran-2-carboxamide
SMILES [?]:
Cc1cc2c(c(oc2cc1C)C(=O)NCc3ccc(cc3)OC)C
InChi [?]:
InChI=1/C20H21NO3/c1-12-9-17-14(3)19(24-18(17)10-13(12)2)20(22)21-11-15-5-7-16(23-4)8-6-15/h5-10H,11H2,1-4H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,11,24,23,17,21,18,20,3,9,15,2,10,5,16,19,4,8,6,12,14,13,22,7/E:(5,6)(7,8)/rA:24nCCCCCCOCCCCCONCCCCCCCOCC/rB:s1;s2;d3;s4;d5;s6;s4s7;d8;d2s9;s10;s6;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;s19;s22;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H21NO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.5192
Area:548.535
Solvation:-3.19423
Coulombic:-39.8918
Bond Count [?]
All:26
Single:18
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:323.386
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.13
LogP (Chemaxon):4.21

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Descriptor Annotations

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