Chemical ID: 7281383

Cc1c2cccc(c2oc1C(=O)NC(C)(C)C)Cl
Chemical ID:
7281383
Name [?]:
7-chloro-3-methyl-N-tert-butyl-benzofuran-2-carboxamide
SMILES [?]:
Cc1c2cccc(c2oc1C(=O)NC(C)(C)C)Cl
InChi [?]:
InChI=1/C14H16ClNO2/c1-8-9-6-5-7-10(15)12(9)18-11(8)13(17)16-14(2,3)4/h5-7H,1-4H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,15,16,17,5,4,6,2,3,7,10,8,11,14,18,13,12,9/E:(2,3,4)/rA:18nCCCCCCCCOCCONCCCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d2s9;s10;d11;s11;s13;s14;s14;s14;s7;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H16ClNO2
All Atoms:34
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.66233
Area:446.336
Solvation:-1.49606
Coulombic:-32.8718
Bond Count [?]
All:19
Single:14
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:265.735
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.55
LogP (Chemaxon):3.11

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Descriptor Annotations

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