Chemical ID: 7701897

c1ccc(cc1)CNC(=O)c2ccc(cc2)NC(=O)c3cccc(c3)Cl
Chemical ID:
7701897
Name [?]:
None
SMILES [?]:
c1ccc(cc1)CNC(=O)c2ccc(cc2)NC(=O)c3cccc(c3)Cl
InChi [?]:
InChI=1/C21H17ClN2O2/c22-18-8-4-7-17(13-18)21(26)24-19-11-9-16(10-12-19)20(25)23-14-15-5-2-1-3-6-15/h1-13H,14H2,(H,23,25)(H,24,26)
InChi Info:
AuxInfo=1/1/N:1,2,6,22,3,5,21,23,12,16,13,15,25,7,4,11,20,24,14,9,18,26,8,17,10,19/E:(2,3)(5,6)(9,10)(11,12)/rA:26nCCCCCCCNCOCCCCCCNCOCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s14;s17;d18;s18;s20;d21;s22;d23;d20s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H17ClN2O2
All Atoms:43
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:12.1951
Area:603.416
Solvation:-2.89033
Coulombic:-46.5855
Bond Count [?]
All:28
Single:17
Double:11
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.73
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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