Chemical ID: 4246417

Cc1ccc2c(c1)c(c(o2)C(=O)N(C)c3ccccc3)C
Chemical ID:
4246417
Name [?]:
N,3,5-trimethyl-N-phenyl-benzofuran-2-carboxamide
SMILES [?]:
Cc1ccc2c(c1)c(c(o2)C(=O)N(C)c3ccccc3)C
InChi [?]:
InChI=1/C18H17NO2/c1-12-9-10-16-15(11-12)13(2)17(21-16)18(20)19(3)14-7-5-4-6-8-14/h4-11H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,21,14,18,17,19,16,20,3,4,7,2,8,15,6,5,9,11,13,12,10/E:(5,6)(7,8)/rA:21nCCCCCCCCCOCONCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s5s9;s9;d11;s11;s13;s13;s15;d16;s17;d18;d15s19;s8;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H17NO2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.99356
Area:466.526
Solvation:-1.66961
Coulombic:-28.8264
Bond Count [?]
All:23
Single:15
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:279.333
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.77
LogP (Chemaxon):4.15

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Descriptor Annotations

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