Chemical ID: 5607656

Cc1ccccc1N(CCCN2C(=O)c3cccc4c3c(ccc4)C2=O)C(=O)c5ccccc5
Chemical ID:
5607656
Name [?]:
None
SMILES [?]:
Cc1ccccc1N(CCCN2C(=O)c3cccc4c3c(ccc4)C2=O)C(=O)c5ccccc5
InChi [?]:
InChI=1/C29H24N2O3/c1-20-10-5-6-17-25(20)30(27(32)22-11-3-2-4-12-22)18-9-19-31-28(33)23-15-7-13-21-14-8-16-24(26(21)23)29(31)34/h2-8,10-17H,9,18-19H2,1H3
InChi Info:
AuxInfo=1/0/N:1,32,31,33,4,5,17,23,10,3,30,34,18,24,16,22,6,9,11,2,19,29,15,21,7,20,27,13,25,8,12,28,14,26/E:(3,4)(7,8)(11,12)(13,14)(15,16)(23,24)(28,29)(33,34)/rA:34nCCCCCCCNCCCNCOCCCCCCCCCCCOCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s20;d21;s22;s19d23;s12s21;d25;s8;d27;s27;s29;d30;s31;d32;d29s33;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C29H24N2O3
All Atoms:34
Heavy Atoms:34
Chiral Atoms:0
ZAP Information [?]
Total:13.1275
Area:653.146
Solvation:-3.20114
Coulombic:-48.1121
Bond Count [?]
All:38
Single:24
Double:14
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:448.513
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:5.91
LogP (Chemaxon):4.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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