Chemical ID: 4508819

c1ccc2c(c1)c(c3ccccc3n2)NCC(=O)O
Chemical ID:
4508819
Name [?]:
2-acridin-9-ylaminoacetic acid
SMILES [?]:
c1ccc2c(c1)c(c3ccccc3n2)NCC(=O)O
InChi [?]:
InChI=1/C15H12N2O2/c18-14(19)9-16-15-10-5-1-3-7-12(10)17-13-8-4-2-6-11(13)15/h1-8H,9H2,(H,16,17)(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,10,2,11,6,9,3,12,16,5,8,4,13,17,7,15,14,18,19/E:(1,2)(3,4)(5,6)(7,8)(10,11)(12,13)(18,19)/rA:19nCCCCCCCCCCCCCNNCCOO/rB:s1;d2;s3;s4;d1s5;d5;s7;s8;d9;s10;d11;d8s12;d4s13;s7;s15;s16;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12N2O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.86326
Area:426.994
Solvation:-2.81159
Coulombic:-45.0375
Bond Count [?]
All:21
Single:13
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:252.268
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.51
LogP (Chemaxon):0.84

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