Chemical ID: 7343215

Cc1ccc(c(c1)n2c(=O)c(c([nH]c2=O)O)C3c4c(c5cc(ccc5[nH]4)OC)CCN3)C
Chemical ID:
7343215
Name [?]:
None
SMILES [?]:
Cc1ccc(c(c1)n2c(=O)c(c([nH]c2=O)O)C3c4c(c5cc(ccc5[nH]4)OC)CCN3)C
InChi [?]:
InChI=1/C24H24N4O4/c1-12-4-5-13(2)18(10-12)28-23(30)19(22(29)27-24(28)31)21-20-15(8-9-25-21)16-11-14(32-3)6-7-17(16)26-20/h4-7,10-11,21,25-26,29H,8-9H2,1-3H3,(H,27,31)
InChi Info:
AuxInfo=1/1/N:1,32,28,3,4,23,24,29,30,7,21,2,5,22,19,20,25,6,11,18,17,12,9,14,31,26,13,8,16,10,15,27/rA:32cCCCCCCCNCOCCNCOOCCCCCCCCCNOCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;d11;s12;s8s13;d14;s12;s11;s17;d18;s19;s20;d21;s22;d23;d20s24;s18s25;s22;s27;s19;s29;s17s30;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H24N4O4
All Atoms:56
Heavy Atoms:32
Chiral Atoms:1
ZAP Information [?]
Total:10.1083
Area:621.934
Solvation:-5.44001
Coulombic:-80.6178
Bond Count [?]
All:36
Single:26
Double:10
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:432.472
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.43
LogP (Chemaxon):1.9

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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