Chemical ID: 4831432

Cc1ccccc1NC(=O)c2cccc3c2nc4ccccc4n3
Chemical ID:
4831432
Name [?]:
N-(o-tolyl)phenazine-1-carboxamide
SMILES [?]:
Cc1ccccc1NC(=O)c2cccc3c2nc4ccccc4n3
InChi [?]:
InChI=1/C20H15N3O/c1-13-7-2-3-9-15(13)23-20(24)14-8-6-12-18-19(14)22-17-11-5-4-10-16(17)21-18/h2-12H,1H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,4,5,21,20,13,3,12,6,22,19,14,2,11,7,23,18,15,16,9,24,17,8,10/rA:24nCCCCCCCNCOCCCCCCNCCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;d17;s18;d19;s20;d21;s18s22;s15d23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H15N3O
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.71218
Area:502.408
Solvation:-2.84801
Coulombic:-34.1437
Bond Count [?]
All:27
Single:16
Double:11
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:313.353
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.09
LogP (Chemaxon):3.9

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