Chemical ID: 7722578

Cc1cccc(c1)Cc2cnc(s2)NC(=O)c3cc4ccccc4o3
Chemical ID:
7722578
Name [?]:
None
SMILES [?]:
Cc1cccc(c1)Cc2cnc(s2)NC(=O)c3cc4ccccc4o3
InChi [?]:
InChI=1/C20H16N2O2S/c1-13-5-4-6-14(9-13)10-16-12-21-20(25-16)22-19(23)18-11-15-7-2-3-8-17(15)24-18/h2-9,11-12H,10H2,1H3,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,21,22,4,3,5,20,23,7,8,18,10,2,6,19,9,24,17,15,12,11,14,16,25,13/rA:25nCCCCCCCCCCNCSNCOCCCCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;d11;s9s12;s12;s14;d15;s15;d17;s18;s19;d20;s21;d22;d19s23;s17s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H16N2O2S
All Atoms:41
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:11.217
Area:565.81
Solvation:-2.92829
Coulombic:-37.6656
Bond Count [?]
All:28
Single:18
Double:10
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.44
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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