Chemical ID: 6868571

COc1ccc(cc1OC)c2cc(=Nc3ccc(cc3)O)c4ccccc4o2
Chemical ID:
6868571
Name [?]:
4-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]aminophenol
SMILES [?]:
COc1ccc(cc1OC)c2cc(=Nc3ccc(cc3)O)c4ccccc4o2
InChi [?]:
InChI=1/C23H19NO4/c1-26-21-12-7-15(13-23(21)27-2)22-14-19(18-5-3-4-6-20(18)28-22)24-16-8-10-17(25)11-9-16/h3-14,25H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,10,24,25,23,26,5,16,20,17,19,4,7,12,6,15,18,22,13,27,3,11,8,14,21,2,9,28/E:(8,9)(10,11)/rA:28nCOCCCCCCOCCCCNCCCCCCOCCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s6;d11;s12;w13;s14;s15;d16;s17;d18;d15s19;s18;s13;s22;d23;s24;d25;d22s26;s11s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H19NO4
All Atoms:47
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:8.21493
Area:572.907
Solvation:-6.10774
Coulombic:-44.8713
Bond Count [?]
All:31
Single:20
Double:11
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:373.401
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.45
LogP (Chemaxon):5.36

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Descriptor Annotations

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