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Chemical ID: 6963707

Chemical ID:

6963707

Name [?]:

2-(4-ethoxyphenyl)amino-N-[1-(2-hydroxyphenyl)ethylideneamino]acetamide

SMILES [?]:

CCOc1ccc(cc1)NCC(=O)NN=C(C)c2ccccc2O

InChi [?]:

InChI=1/C18H21N3O3/c1-3-24-15-10-8-14(9-11-15)19-12-18(23)21-20-13(2)16-6-4-5-7-17(16)22/h4-11,19,22H,3,12H2,1-2H3,(H,21,23)

InChi Info:

AuxInfo=1/1/N:1,17,2,20,21,19,22,6,8,5,9,11,16,7,4,18,23,12,10,15,14,24,13,3/E:(8,9)(10,11)/rA:24nCCOCCCCCCNCCONNCCCCCCCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;w15;s16;s16;s18;d19;s20;d21;d18s22;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₁N₃O₃
All Atoms:	45
Heavy Atoms:	24
Chiral Atoms:	0

ZAP Information [?]

Total:	7.65255
Area:	566.106
Solvation:	-6.5001
Coulombic:	-52.4408

Bond Count [?]

All:	25
Single:	17
Double:	8
Rotors:	8
Chiral:	1
Rigid Segments:	6

Chemical Properties

Molecular Weight:	327.378
H-Bond Donors:	3
H-Bond Acceptors:	6
XLogP:	3.48
LogP (Chemaxon):	2.28

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