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Chemical ID: 7699121
Chemical ID:
7699121
Name [?]:
None
SMILES [?]:
c1ccc(cc1)CCCC(=O)Nc2cccc(c2)NC(=O)CCCc3ccccc3
InChi [?]:
InChI=1/C26H28N2O2/c29-25(18-7-14-21-10-3-1-4-11-21)27-23-16-9-17-24(20-23)28-26(30)19-8-15-22-12-5-2-6-13-22/h1-6,9-13,16-17,20H,7-8,14-15,18-19H2,(H,27,29)(H,28,30)
InChi Info:
AuxInfo=1/1/N:1,28,2,6,27,29,8,23,15,3,5,26,30,7,24,14,16,9,22,18,4,25,13,17,10,20,12,19,11,21/E:(1,2)(3,4,5,6)(7,8)(10,11,12,13)(14,15)(16,17)(18,19)(21,22)(23,24)(25,26)(27,28)(29,30)/gE:(1,2)/rA:30nCCCCCCCCCCONCCCCCCNCOCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;s19;d20;s20;s22;s23;s24;s25;d26;s27;d28;d25s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C26H28N2O2 |
All Atoms: | 58 |
Heavy Atoms: | 30 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 13.3005 |
Area: | 695.281 |
Solvation: | -4.08155 |
Coulombic: | -42.5506 |
Bond Count [?]
All: | 32 |
Single: | 21 |
Double: | 11 |
Rotors: | 12 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.06 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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