Chemical ID: 7293648

c1ccc2c(c1)ccc3c2c(co3)CC(=O)NCc4ccncc4
Chemical ID:
7293648
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ccc3c2c(co3)CC(=O)NCc4ccncc4
InChi [?]:
InChI=1/C20H16N2O2/c23-19(22-12-14-7-9-21-10-8-14)11-16-13-24-18-6-5-15-3-1-2-4-17(15)20(16)18/h1-10,13H,11-12H2,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,7,8,20,24,21,23,14,18,12,19,5,11,4,9,15,10,22,17,16,13/E:(7,8)(9,10)/rA:24nCCCCCCCCCCCCOCCONCCCCNCC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;d11;s9s12;s11;s14;d15;s15;s17;s18;s19;d20;s21;d22;d19s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H16N2O2
All Atoms:40
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.77692
Area:522.804
Solvation:-4.29317
Coulombic:-32.4251
Bond Count [?]
All:27
Single:17
Double:10
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:316.353
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.92
LogP (Chemaxon):3.1

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Descriptor Annotations

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