Chemical ID: 6427134

Cc1ccc(cc1)N(c2ccccc2)c3ccccc3C(=O)O
Chemical ID:
6427134
Name [?]:
2-(phenyl-(p-tolyl)amino)benzoic acid
SMILES [?]:
Cc1ccc(cc1)N(c2ccccc2)c3ccccc3C(=O)O
InChi [?]:
InChI=1/C20H17NO2/c1-15-11-13-17(14-12-15)21(16-7-3-2-4-8-16)19-10-6-5-9-18(19)20(22)23/h2-14H,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,12,11,13,18,17,10,14,19,16,3,7,4,6,2,9,5,20,15,21,8,22,23/E:(3,4)(7,8)(11,12)(13,14)(22,23)/rA:23nCCCCCCCNCCCCCCCCCCCCCOO/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s11;d12;d9s13;s8;s15;d16;s17;d18;d15s19;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H17NO2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.97524
Area:484.229
Solvation:-2.13049
Coulombic:-36.4975
Bond Count [?]
All:25
Single:15
Double:10
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:303.355
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.41
LogP (Chemaxon):5.21

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