Chemical ID: 4725110

c1ccc2c(c1)C(=O)Nc3ccccc3N2
Chemical ID:
4725110
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)C(=O)Nc3ccccc3N2
InChi [?]:
InChI=1/C13H10N2O/c16-13-9-5-1-2-6-10(9)14-11-7-3-4-8-12(11)15-13/h1-8,14H,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,2,13,12,6,3,14,11,5,4,15,10,7,16,9,8/rA:16nCCCCCCCONCCCCCCN/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;d11;s12;d13;d10s14;s4s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10N2O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.48882
Area:364.793
Solvation:-1.631
Coulombic:-34.468
Bond Count [?]
All:18
Single:11
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:210.231
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:2.56
LogP (Chemaxon):2.96

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