Chemical ID: 5646309

Cc1c2cc(ccc2oc1C(=O)Nc3ccc4ccccc4c3)Br
Chemical ID:
5646309
Name [?]:
5-bromo-3-methyl-N-(2-naphthyl)benzofuran-2-carboxamide
SMILES [?]:
Cc1c2cc(ccc2oc1C(=O)Nc3ccc4ccccc4c3)Br
InChi [?]:
InChI=1/C20H14BrNO2/c1-12-17-11-15(21)7-9-18(17)24-19(12)20(23)22-16-8-6-13-4-2-3-5-14(13)10-16/h2-11H,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,19,20,18,21,16,6,15,7,23,4,2,17,22,5,14,3,8,10,11,24,13,12,9/rA:24nCCCCCCCCOCCONCCCCCCCCCCBr/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d2s9;s10;d11;s11;s13;s14;d15;s16;s17;d18;s19;d20;d17s21;d14s22;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H14BrNO2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.1411
Area:525.228
Solvation:-1.98957
Coulombic:-33.1024
Bond Count [?]
All:27
Single:17
Double:10
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:380.235
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.26
LogP (Chemaxon):5.71

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