Chemical ID: 6853083

Cc1ccc2c(c1)c(=Nc3ccc(cc3)Cl)cc(o2)c4ccc(c(c4)OC)OC
Chemical ID:
6853083
Name [?]:
N-(4-chlorophenyl)-2-(3,4-dimethoxyphenyl)-6-methyl-chromen-4-imine
SMILES [?]:
Cc1ccc2c(c1)c(=Nc3ccc(cc3)Cl)cc(o2)c4ccc(c(c4)OC)OC
InChi [?]:
InChI=1/C24H20ClNO3/c1-15-4-10-21-19(12-15)20(26-18-8-6-17(25)7-9-18)14-23(29-21)16-5-11-22(27-2)24(13-16)28-3/h4-14H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,29,27,3,21,12,14,11,15,4,22,7,25,17,2,20,13,10,6,8,5,23,18,24,16,9,28,26,19/E:(6,7)(8,9)/rA:29nCCCCCCCCNCCCCCCClCCOCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;w8;s9;s10;d11;s12;d13;d10s14;s13;s8;d17;s5s18;s18;s20;d21;s22;d23;d20s24;s24;s26;s23;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20ClNO3
All Atoms:49
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:10.3642
Area:626.577
Solvation:-5.30025
Coulombic:-29.6882
Bond Count [?]
All:32
Single:21
Double:11
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:405.873
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:5.91
LogP (Chemaxon):6.62

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Descriptor Annotations

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