Chemical ID: 4971480

c1cc(ccc1C=O)N(c2ccc(cc2)C=O)c3ccc(cc3)C=O
Chemical ID:
4971480
Name [?]:
4-bis(4-formylphenyl)aminobenzaldehyde
SMILES [?]:
c1cc(ccc1C=O)N(c2ccc(cc2)C=O)c3ccc(cc3)C=O
InChi [?]:
InChI=1/C21H15NO3/c23-13-16-1-7-19(8-2-16)22(20-9-3-17(14-24)4-10-20)21-11-5-18(15-25)6-12-21/h1-15H
InChi Info:
AuxInfo=1/0/N:1,5,12,14,20,22,2,4,11,15,19,23,7,16,24,6,13,21,3,10,18,9,8,17,25/E:(1,2,3,4,5,6)(7,8,9,10,11,12)(13,14,15)(16,17,18)(19,20,21)(23,24,25)/rA:25nCCCCCCCONCCCCCCCOCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s6;d7;s3;s9;s10;d11;s12;d13;d10s14;s13;d16;s9;s18;d19;s20;d21;d18s22;s21;d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H15NO3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.20558
Area:550.613
Solvation:-5.55973
Coulombic:-28.2357
Bond Count [?]
All:27
Single:15
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:329.349
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.45
LogP (Chemaxon):4.25

Name Annotations

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Descriptor Annotations

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