Chemical ID: 7090673

Cc1ccccc1NC(c2ccccc2)C(=O)O
Chemical ID:
7090673
Name [?]:
2-(o-tolylamino)-2-phenyl-acetic acid
SMILES [?]:
Cc1ccccc1NC(c2ccccc2)C(=O)O
InChi [?]:
InChI=1/C15H15NO2/c1-11-7-5-6-10-13(11)16-14(15(17)18)12-8-3-2-4-9-12/h2-10,14,16H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,13,12,14,4,5,3,11,15,6,2,10,7,9,16,8,17,18/E:(3,4)(8,9)(17,18)/rA:18cCCCCCCCNCCCCCCCCOO/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s9;d16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NO2
All Atoms:33
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:8.35716
Area:431.145
Solvation:-2.42147
Coulombic:-41.7521
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:241.285
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.85
LogP (Chemaxon):3.6

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Descriptor Annotations

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