Chemical ID: 6346857

c1ccc-2c(c1)CC(=O)n3c2nc4c3cccc4
Chemical ID:
6346857
Name [?]:
None
SMILES [?]:
c1ccc-2c(c1)CC(=O)n3c2nc4c3cccc4
InChi [?]:
InChI=1/C15H10N2O/c18-14-9-10-5-1-2-6-11(10)15-16-12-7-3-4-8-13(12)17(14)15/h1-8H,9H2
InChi Info:
AuxInfo=1/0/N:1,2,17,16,6,3,18,15,7,5,4,13,14,8,11,12,10,9/rA:18nCCCCCCCCONCNCCCCCC/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s4s10;d11;s12;s10s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10N2O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.96972
Area:391.212
Solvation:-1.81058
Coulombic:-22.8591
Bond Count [?]
All:21
Single:13
Double:8
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:234.253
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.15
LogP (Chemaxon):3.16

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Descriptor Annotations

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