Chemical ID: 6896827

Cc1ccccc1NC(=O)COc2c(=O)c3ccccc3oc2c4ccco4
Chemical ID:
6896827
Name [?]:
2-[2-(2-furyl)-4-oxo-chromen-3-yl]oxy-N-(o-tolyl)acetamide
SMILES [?]:
Cc1ccccc1NC(=O)COc2c(=O)c3ccccc3oc2c4ccco4
InChi [?]:
InChI=1/C22H17NO5/c1-14-7-2-4-9-16(14)23-19(24)13-27-22-20(25)15-8-3-5-10-17(15)28-21(22)18-11-6-12-26-18/h2-12H,13H2,1H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,4,18,5,19,26,3,17,6,20,25,27,11,2,16,7,21,24,9,14,23,13,8,10,15,28,12,22/rA:28nCCCCCCCNCOCOCCOCCCCCCOCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;s13;d14;s14;s16;d17;s18;d19;d16s20;s21;d13s22;s23;d24;s25;d26;s24s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H17NO5
All Atoms:45
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:8.60857
Area:578.805
Solvation:-5.86156
Coulombic:-53.4065
Bond Count [?]
All:31
Single:20
Double:11
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:375.374
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.54
LogP (Chemaxon):3.21

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Descriptor Annotations

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