Chemical ID: 7746187

Cc1ccc(cc1)C2CC(=NN2C(=O)c3ccco3)c4ccccc4O
Chemical ID:
7746187
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)C2CC(=NN2C(=O)c3ccco3)c4ccccc4O
InChi [?]:
InChI=1/C21H18N2O3/c1-14-8-10-15(11-9-14)18-13-17(16-5-2-3-6-19(16)24)22-23(18)21(25)20-7-4-12-26-20/h2-12,18,24H,13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,22,23,17,21,24,16,3,7,4,6,18,9,2,5,20,10,8,25,15,13,11,12,26,14,19/E:(8,9)(10,11)/rA:26cCCCCCCCCCCNNCOCCCCOCCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s8s11;s12;d13;s13;d15;s16;d17;s15s18;s10;s20;d21;s22;d23;d20s24;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H18N2O3
All Atoms:44
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:8.81855
Area:536.913
Solvation:-4.60426
Coulombic:-40.9374
Bond Count [?]
All:29
Single:19
Double:10
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.2
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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