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Chemical ID: 7741763
Chemical ID:
7741763
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1C)N2CC(CC2=O)C(=O)N3CCC4(CC3)CC(=O)c5ccccc5O4
InChi [?]:
InChI=1/C26H28N2O4/c1-17-7-8-20(13-18(17)2)28-16-19(14-24(28)30)25(31)27-11-9-26(10-12-27)15-22(29)21-5-3-4-6-23(21)32-26/h3-8,13,19H,9-12,14-16H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,28,29,27,30,3,4,19,21,18,22,6,12,23,10,2,7,11,5,26,24,31,13,15,20,17,9,25,14,16,32/E:(9,10)(11,12)/rA:32cCCCCCCCCNCCCCOCONCCCCCCCOCCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s10;s11;s9s12;d13;s11;d15;s15;s17;s18;s19;s20;s17s21;s20;s23;d24;s24;s26;d27;s28;d29;d26s30;s20s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C26H28N2O4 |
All Atoms: | 60 |
Heavy Atoms: | 32 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.0907 |
Area: | 638.414 |
Solvation: | -4.86966 |
Coulombic: | -46.2692 |
Bond Count [?]
All: | 36 |
Single: | 27 |
Double: | 9 |
Rotors: | 3 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.98 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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