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Chemical ID: 5007523

CCc1ccc(cc1)C(c2ccc(cc2)CC)(C(=O)NN=C3c4ccccc4NC3=O)O

Chemical ID:

5007523

Name [?]:

2,2-bis(4-ethylphenyl)-2-hydroxy-N-(2-oxoindolin-3-ylidene)amino-acetamide

SMILES [?]:

CCc1ccc(cc1)C(c2ccc(cc2)CC)(C(=O)NN=C3c4ccccc4NC3=O)O

InChi [?]:

InChI=1/C26H25N3O3/c1-3-17-9-13-19(14-10-17)26(32,20-15-11-18(4-2)12-16-20)25(31)29-28-23-21-7-5-6-8-22(21)27-24(23)30/h5-16,32H,3-4H2,1-2H3,(H,29,31)(H,27,28,30)

InChi Info:

AuxInfo=1/1/N:1,17,2,16,25,26,24,27,4,8,12,14,5,7,11,15,3,13,6,10,23,28,22,30,18,9,29,21,20,31,19,32/E:(1,2)(3,4)(9,10,11,12)(13,14,15,16)(17,18)(19,20)/rA:32nCCCCCCCCCCCCCCCCCCONNCCCCCCCNCOO/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s12;d13;d10s14;s13;s16;s9;d18;s18;s20;w21;s22;s23;d24;s25;d26;d23s27;s28;s22s29;d30;s9;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₆H₂₅N₃O₃
All Atoms:	32
Heavy Atoms:	32
Chiral Atoms:	0

ZAP Information [?]

Total:	12.6644
Area:	668.338
Solvation:	-4.04401
Coulombic:	-64.4267

Bond Count [?]

All:	35
Single:	23
Double:	12
Rotors:	7
Chiral:	1
Rigid Segments:	7

Chemical Properties

Molecular Weight:	427.495
H-Bond Donors:	3
H-Bond Acceptors:	6
XLogP:	5.45
LogP (Chemaxon):	5.7

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

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