Chemical ID: 6666101

COc1ccc(cc1OC)C=Nc2ccc(cc2)N=Cc3ccc(c(c3)OC)OC
Chemical ID:
6666101
Name [?]:
1-(3,4-dimethoxyphenyl)-N-[4-[(3,4-dimethoxyphenyl)methyleneamino]phenyl]-methanimine
SMILES [?]:
COc1ccc(cc1OC)C=Nc2ccc(cc2)N=Cc3ccc(c(c3)OC)OC
InChi [?]:
InChI=1/C24H24N2O4/c1-27-21-11-5-17(13-23(21)29-3)15-25-19-7-9-20(10-8-19)26-16-18-6-12-22(28-2)24(14-18)30-4/h5-16H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,30,10,28,5,22,14,18,15,17,4,23,7,26,11,20,6,21,13,16,3,24,8,25,12,19,2,29,9,27/E:(1,2)(3,4)(5,6)(7,8,9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(29,30)/rA:30nCOCCCCCCOCCNCCCCCCNCCCCCCCOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s6;w11;s12;s13;d14;s15;d16;d13s17;s16;w19;s20;s21;d22;s23;d24;d21s25;s25;s27;s24;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H24N2O4
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:5.15361
Area:568.464
Solvation:-9.058
Coulombic:-38.3872
Bond Count [?]
All:32
Single:21
Double:11
Rotors:8
Chiral:2
Rigid Segments:9
Chemical Properties
Molecular Weight:404.458
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.85
LogP (Chemaxon):5.44

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Descriptor Annotations

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