Chemical ID: 4946294

c1ccc(cc1)COc2cccc(c2)c3cc(=O)c4cc5c(cc4[nH]3)OCO5
Chemical ID:
4946294
Name [?]:
None
SMILES [?]:
c1ccc(cc1)COc2cccc(c2)c3cc(=O)c4cc5c(cc4[nH]3)OCO5
InChi [?]:
InChI=1/C23H17NO4/c25-21-11-19(24-20-12-23-22(10-18(20)21)27-14-28-23)16-7-4-8-17(9-16)26-13-15-5-2-1-3-6-15/h1-12H,13-14H2,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,6,11,3,5,12,10,14,20,16,23,7,27,4,13,9,19,15,24,17,21,22,25,18,8,28,26/E:(2,3)(5,6)/rA:28nCCCCCCCOCCCCCCCCCOCCCCCCNOCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;d10;s11;d12;d9s13;s13;d15;s16;d17;s17;s19;d20;s21;d22;d19s23;s15s24;s22;s26;s21s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H17NO4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.59402
Area:584.651
Solvation:-5.02225
Coulombic:-44.59
Bond Count [?]
All:32
Single:21
Double:11
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:371.385
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:5.12
LogP (Chemaxon):4.65

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