Chemical ID: 4822349

Cc1c(c(c2c(n1)-c3ccccc3C2=O)c4ccccc4)C(=O)C
Chemical ID:
4822349
Name [?]:
None
SMILES [?]:
Cc1c(c(c2c(n1)-c3ccccc3C2=O)c4ccccc4)C(=O)C
InChi [?]:
InChI=1/C21H15NO2/c1-12-17(13(2)23)18(14-8-4-3-5-9-14)19-20(22-12)15-10-6-7-11-16(15)21(19)24/h3-11H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,24,19,18,20,10,11,17,21,9,12,2,22,16,8,13,3,4,5,6,14,7,23,15/E:(4,5)(8,9)/rA:24nCCCCCCNCCCCCCCOCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;d11;d8s12;s5s13;d14;s4;s16;d17;s18;d19;d16s20;s3;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H15NO2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.15828
Area:488.156
Solvation:-3.04564
Coulombic:-22.5683
Bond Count [?]
All:27
Single:16
Double:11
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:313.349
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.43
LogP (Chemaxon):3.16

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Descriptor Annotations

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