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Chemical ID: 4669212

c1ccc(cc1)C2=NN(C(CC2)(c3ccccc3)N=Nc4ccccc4)c5ccccc5

Chemical ID:

4669212

Name [?]:

1,3,6-triphenyl-6-phenylazo-4,5-dihydropyridazine

SMILES [?]:

c1ccc(cc1)C2=NN(C(CC2)(c3ccccc3)N=Nc4ccccc4)c5ccccc5

InChi [?]:

InChI=1/C28H24N4/c1-5-13-23(14-6-1)27-21-22-28(24-15-7-2-8-16-24,31-29-25-17-9-3-10-18-25)32(30-27)26-19-11-4-12-20-26/h1-20H,21-22H2

InChi Info:

AuxInfo=1/0/N:1,16,24,30,2,6,15,17,23,25,29,31,3,5,14,18,22,26,28,32,12,11,4,13,21,27,7,10,20,8,19,9/E:(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)/rA:32cCCCCCCCNNCCCCCCCCCNNCCCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;s9;s10;s7s11;s10;s13;d14;s15;d16;d13s17;s10;w19;s20;s21;d22;s23;d24;d21s25;s9;s27;d28;s29;d30;d27s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₈H₂₄N₄
All Atoms:	32
Heavy Atoms:	32
Chiral Atoms:	1

ZAP Information [?]

Total:	11.4576
Area:	579.572
Solvation:	-3.03174
Coulombic:	-15.7175

Bond Count [?]

All:	36
Single:	22
Double:	14
Rotors:	5
Chiral:	1
Rigid Segments:	6

Chemical Properties

Molecular Weight:	416.517
H-Bond Donors:	0
H-Bond Acceptors:	4
XLogP:	8.1
LogP (Chemaxon):	8.22

Name Annotations

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Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value