Chemical ID: 4752747

c1ccc(cc1)NC(=O)Nc2cccc(c2)C(=O)O
Chemical ID:
4752747
Name [?]:
3-(phenylcarbamoylamino)benzoic acid
SMILES [?]:
c1ccc(cc1)NC(=O)Nc2cccc(c2)C(=O)O
InChi [?]:
InChI=1/C14H12N2O3/c17-13(18)10-5-4-8-12(9-10)16-14(19)15-11-6-2-1-3-7-11/h1-9H,(H,17,18)(H2,15,16,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,13,14,3,5,12,16,15,4,11,17,8,7,10,18,19,9/E:(2,3)(6,7)(17,18)/rA:19nCCCCCCNCONCCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s15;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12N2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.28517
Area:443.545
Solvation:-2.80345
Coulombic:-62.5545
Bond Count [?]
All:20
Single:12
Double:8
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:256.257
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:2.1
LogP (Chemaxon):3.02

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