Chemical ID: 7028759

Cc1cccc(c1)NC(=O)c2ccc(o2)c3ccccc3Cl
Chemical ID:
7028759
Name [?]:
5-(2-chlorophenyl)-N-(m-tolyl)furan-2-carboxamide
SMILES [?]:
Cc1cccc(c1)NC(=O)c2ccc(o2)c3ccccc3Cl
InChi [?]:
InChI=1/C18H14ClNO2/c1-12-5-4-6-13(11-12)20-18(21)17-10-9-16(22-17)14-7-2-3-8-15(14)19/h2-11H,1H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,18,19,4,3,5,17,20,13,12,7,2,6,16,21,14,11,9,22,8,10,15/rA:22nCCCCCCCNCOCCCCOCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;d11;s12;d13;s11s14;s14;s16;d17;s18;d19;d16s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H14ClNO2
All Atoms:36
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.4794
Area:510.348
Solvation:-2.2793
Coulombic:-33.1033
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:311.762
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.7
LogP (Chemaxon):4.48

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