Chemical ID: 7184952

Cc1cc(ccc1OC)C(=O)C2C(N(C(=O)C2=O)CCOC)c3ccc(c(c3)OC)OC
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

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue