Chemical ID: 7416283

Cc1cc(c2c(c1)c(cc(=O)o2)CN3CCN(CC3)c4ccccc4OC)C
Chemical ID:
7416283
Name [?]:
4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6,8-dimethyl-chromen-2-one
SMILES [?]:
Cc1cc(c2c(c1)c(cc(=O)o2)CN3CCN(CC3)c4ccccc4OC)C
InChi [?]:
InChI=1/C23H26N2O3/c1-16-12-17(2)23-19(13-16)18(14-22(26)28-23)15-24-8-10-25(11-9-24)20-6-4-5-7-21(20)27-3/h4-7,12-14H,8-11,15H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,28,27,22,23,21,24,15,19,16,18,3,7,9,13,2,4,8,6,20,25,10,5,14,17,11,26,12/E:(8,9)(10,11)/rA:28nCCCCCCCCCCOOCNCCNCCCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s9;d10;s5s10;s8;s13;s14;s15;s16;s17;s14s18;s17;s20;d21;s22;d23;d20s24;s25;s26;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H26N2O3
All Atoms:54
Heavy Atoms:28
Chiral Atoms:None
ZAP Information [?]
Total:9.95925
Area:598.386
Solvation:-5.00041
Coulombic:-37.8067
Bond Count [?]
All:31
Single:23
Double:8
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.83
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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