Chemical ID: 6883491

Cc1ccc2c(c1)c(=Nc3ccccn3)cc(o2)c4ccc(c(c4)OC)OC
Chemical ID:
6883491
Name [?]:
2-(3,4-dimethoxyphenyl)-6-methyl-N-(2-pyridyl)chromen-4-imine
SMILES [?]:
Cc1ccc2c(c1)c(=Nc3ccccn3)cc(o2)c4ccc(c(c4)OC)OC
InChi [?]:
InChI=1/C23H20N2O3/c1-15-7-9-19-17(12-15)18(25-23-6-4-5-11-24-23)14-21(28-19)16-8-10-20(26-2)22(13-16)27-3/h4-14H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,28,26,12,13,11,3,20,4,21,14,7,24,16,2,19,6,8,5,22,17,23,10,15,9,27,25,18/rA:28nCCCCCCCCNCCCCCNCCOCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;w8;s9;s10;d11;s12;d13;d10s14;s8;d16;s5s17;s17;s19;d20;s21;d22;d19s23;s23;s25;s22;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H20N2O3
All Atoms:48
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:8.94901
Area:588.677
Solvation:-5.76792
Coulombic:-33.8923
Bond Count [?]
All:31
Single:20
Double:11
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:372.417
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.76
LogP (Chemaxon):5.49

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Descriptor Annotations

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