Chemical ID: 6847431

Cc1cc(c2c(c1)oc(c(c2=O)OCC(=O)Nc3ccc(cc3)OC)c4ccc(cc4)OC)C
Chemical ID:
6847431
Name [?]:
N-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-5,7-dimethyl-4-oxo-chromen-3-yl]oxy-acetamide
SMILES [?]:
Cc1cc(c2c(c1)oc(c(c2=O)OCC(=O)Nc3ccc(cc3)OC)c4ccc(cc4)OC)C
InChi [?]:
InChI=1/C27H25NO6/c1-16-13-17(2)24-22(14-16)34-26(18-5-9-20(31-3)10-6-18)27(25(24)30)33-15-23(29)28-19-7-11-21(32-4)12-8-19/h5-14H,15H2,1-4H3,(H,28,29)
InChi Info:
AuxInfo=1/1/N:1,34,33,25,27,31,19,23,28,30,20,22,3,7,14,2,4,26,18,29,21,6,15,5,11,9,10,17,16,12,32,24,13,8/E:(5,6)(7,8)(9,10)(11,12)/rA:34nCCCCCCCOCCCOOCCONCCCCCCOCCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s5s10;d11;s10;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s21;s24;s9;s26;d27;s28;d29;d26s30;s29;s32;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C27H25NO6
All Atoms:59
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:9.91286
Area:691.439
Solvation:-7.37312
Coulombic:-60.5946
Bond Count [?]
All:37
Single:25
Double:12
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:459.491
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:5.31
LogP (Chemaxon):4.88

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Descriptor Annotations

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