Chemical ID: 7089965

COc1ccccc1NC(c2ccccc2)C(=O)O
Chemical ID:
7089965
Name [?]:
2-(2-methoxyphenyl)amino-2-phenyl-acetic acid
SMILES [?]:
COc1ccccc1NC(c2ccccc2)C(=O)O
InChi [?]:
InChI=1/C15H15NO3/c1-19-13-10-6-5-9-12(13)16-14(15(17)18)11-7-3-2-4-8-11/h2-10,14,16H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,14,13,15,6,5,12,16,7,4,11,8,3,10,17,9,18,19,2/E:(3,4)(7,8)(17,18)/rA:19cCOCCCCCCNCCCCCCCCOO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s10;s11;d12;s13;d14;d11s15;s10;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NO3
All Atoms:34
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:7.37457
Area:447.536
Solvation:-3.81383
Coulombic:-48.8358
Bond Count [?]
All:20
Single:13
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:257.285
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.54
LogP (Chemaxon):2.4

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