Chemical ID: 7707499

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)C(C)Oc3cccc4c3cccc4
Chemical ID:
7707499
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)C(C)Oc3cccc4c3cccc4
InChi [?]:
InChI=1/C28H26N2O3/c1-20-10-12-23(13-11-20)19-32-25-16-14-22(15-17-25)18-29-30-28(31)21(2)33-27-9-5-7-24-6-3-4-8-26(24)27/h3-18,21H,19H2,1-2H3,(H,30,31)
InChi Info:
AuxInfo=1/1/N:1,22,32,31,26,33,27,30,25,3,7,4,6,12,14,11,15,16,8,2,21,13,5,28,10,29,24,19,17,18,20,9,23/E:(10,11)(12,13)(14,15)(16,17)/rA:33cCCCCCCCCOCCCCCCCNNCOCCOCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s13;w16;s17;s18;d19;s19;s21;s21;s23;s24;d25;s26;d27;d24s28;s29;d30;s31;s28d32;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C28H26N2O3
All Atoms:59
Heavy Atoms:33
Chiral Atoms:None
ZAP Information [?]
Total:10.61
Area:698.019
Solvation:-6.84051
Coulombic:-36.8523
Bond Count [?]
All:36
Single:23
Double:13
Rotors:9
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:7.53
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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