Chemical ID: 5392949

Cc1ccc(c(c1)C)NC(=O)c2cccc3c2nc4ccccc4n3
Chemical ID:
5392949
Name [?]:
N-(2,4-dimethylphenyl)phenazine-1-carboxamide
SMILES [?]:
Cc1ccc(c(c1)C)NC(=O)c2cccc3c2nc4ccccc4n3
InChi [?]:
InChI=1/C21H17N3O/c1-13-10-11-16(14(2)12-13)24-21(25)15-6-5-9-19-20(15)23-18-8-4-3-7-17(18)22-19/h3-12H,1-2H3,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,8,22,21,14,13,23,20,15,3,4,7,2,6,12,5,24,19,16,17,10,25,18,9,11/rA:25nCCCCCCCCNCOCCCCCCNCCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;d18;s19;d20;s21;d22;s19s23;s16d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H17N3O
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.2714
Area:526.283
Solvation:-2.88567
Coulombic:-33.8917
Bond Count [?]
All:28
Single:17
Double:11
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:327.379
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.52
LogP (Chemaxon):4.36

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Descriptor Annotations

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