Chemical ID: 7455000

Cc1cc2c(cc1C)oc3c(c2=O)C(N(C3=O)Cc4ccco4)c5ccc(cc5)N(=O)=O
Chemical ID:
7455000
Name [?]:
None
SMILES [?]:
Cc1cc2c(cc1C)oc3c(c2=O)C(N(C3=O)Cc4ccco4)c5ccc(cc5)N(=O)=O
InChi [?]:
InChI=1/C24H18N2O6/c1-13-10-18-19(11-14(13)2)32-23-20(22(18)27)21(15-5-7-16(8-6-15)26(29)30)25(24(23)28)12-17-4-3-9-31-17/h3-11,21H,12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,21,20,25,29,26,28,22,3,6,18,2,7,24,27,19,4,5,11,14,12,10,16,15,30,13,17,31,32,23,9/E:(5,6)(7,8)(29,30)/CRV:26.5/rA:32cCCCCCCCCOCCCOCNCOCCCCCOCCCCCCNOO/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s4s11;d12;s11;s14;s10s15;d16;s15;s18;d19;s20;d21;s19s22;s14;s24;d25;s26;d27;d24s28;s27;d30;d30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H18N2O6
All Atoms:50
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:6.0709
Area:599.626
Solvation:-8.91976
Coulombic:-53.8064
Bond Count [?]
All:36
Single:23
Double:13
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:430.41
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:3.59
LogP (Chemaxon):4.27

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Descriptor Annotations

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