Chemical ID: 7691728

c1ccc2c(c1)c(c[nH]2)C(=O)C(=O)NCc3cccnc3
Chemical ID:
7691728
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)c(c[nH]2)C(=O)C(=O)NCc3cccnc3
InChi [?]:
InChI=1/C16H13N3O2/c20-15(13-10-18-14-6-2-1-5-12(13)14)16(21)19-9-11-4-3-7-17-8-11/h1-8,10,18H,9H2,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,2,18,17,6,3,19,21,15,8,16,5,7,4,10,12,20,9,14,11,13/rA:21nCCCCCCCCNCOCONCCCCCNC/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s7;d10;s10;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H13N3O2
All Atoms:34
Heavy Atoms:21
Chiral Atoms:None
ZAP Information [?]
Total:9.35522
Area:481.556
Solvation:-2.68367
Coulombic:-48.8443
Bond Count [?]
All:23
Single:14
Double:9
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:1.57
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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