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Chemical ID: 7184952
Chemical ID:
7184952
Name [?]:
5-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)-4-(4-methoxy-3-methyl-benzoyl)-pyrrolidine-2,3-dione
SMILES [?]:
Cc1cc(ccc1OC)C(=O)C2C(N(C(=O)C2=O)CCOC)c3ccc(c(c3)OC)OC
InChi [?]:
InChI=1/C24H27NO7/c1-14-12-16(7-8-17(14)30-3)22(26)20-21(25(10-11-29-2)24(28)23(20)27)15-6-9-18(31-4)19(13-15)32-5/h6-9,12-13,20-21H,10-11H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,22,9,32,30,24,5,6,25,19,20,3,28,2,23,4,7,26,27,12,13,10,17,15,14,11,18,16,21,8,31,29/rA:32cCCCCCCCOCCOCCNCOCOCCOCCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s4;d10;s10;s12;s13;s14;d15;s12s15;d17;s14;s19;s20;s21;s13;s23;d24;s25;d26;d23s27;s27;s29;s26;s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H27NO7 |
All Atoms: | 59 |
Heavy Atoms: | 32 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 6.10597 |
Area: | 674.72 |
Solvation: | -10.762 |
Coulombic: | -60.6238 |
Bond Count [?]
All: | 34 |
Single: | 25 |
Double: | 9 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 9 |
Chemical Properties
Molecular Weight: | 441.474 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 8 |
XLogP: | 1.52 |
LogP (Chemaxon): | 2.53 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
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