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Chemical ID: 5259733

Chemical ID:

5259733

Name [?]:

N,N'-bis[(2-aminophenyl)methyl]oxamide

SMILES [?]:

c1ccc(c(c1)CNC(=O)C(=O)NCc2ccccc2N)N

InChi [?]:

InChI=1/C16H18N4O2/c17-13-7-3-1-5-11(13)9-19-15(21)16(22)20-10-12-6-2-4-8-14(12)18/h1-8H,9-10,17-18H2,(H,19,21)(H,20,22)

InChi Info:

AuxInfo=1/1/N:1,17,2,18,6,16,3,19,7,14,5,15,4,20,9,11,22,21,8,13,10,12/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)/gE:(1,2)/rA:22nCCCCCCCNCOCONCCCCCCCNN/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s9;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s20;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₆H₁₈N₄O₂
All Atoms:	22
Heavy Atoms:	22
Chiral Atoms:	0

ZAP Information [?]

Total:	10.647
Area:	525.123
Solvation:	-2.48113
Coulombic:	-81.3857

Bond Count [?]

All:	23
Single:	15
Double:	8
Rotors:	7
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	298.34
H-Bond Donors:	6
H-Bond Acceptors:	6
XLogP:	0.68
LogP (Chemaxon):	0.51

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value