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Chemical ID: 6632795

c1ccc(c(c1)C=NNC(=O)C(=O)Nc2ccccc2C(=O)NC3CCCCC3)O

Chemical ID:

6632795

Name [?]:

N'-[2-(cyclohexylcarbamoyl)phenyl]-N-[(2-hydroxyphenyl)methyleneamino]oxamide

SMILES [?]:

c1ccc(c(c1)C=NNC(=O)C(=O)Nc2ccccc2C(=O)NC3CCCCC3)O

InChi [?]:

InChI=1/C22H24N4O4/c27-19-13-7-4-8-15(19)14-23-26-22(30)21(29)25-18-12-6-5-11-17(18)20(28)24-16-9-2-1-3-10-16/h4-8,11-14,16,27H,1-3,9-10H2,(H,24,28)(H,25,29)(H,26,30)

InChi Info:

AuxInfo=1/1/N:27,26,28,1,18,17,2,6,25,29,19,16,3,7,5,24,20,15,4,21,12,10,8,23,14,9,30,22,13,11/E:(2,3)(9,10)/rA:30nCCCCCCCNNCOCONCCCCCCCONCCCCCCO/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;s9;d10;s10;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;d21;s21;s23;s24;s25;s26;s27;s24s28;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₂₄N₄O₄
All Atoms:	30
Heavy Atoms:	30
Chiral Atoms:	0

ZAP Information [?]

Total:	11.7792
Area:	640.039
Solvation:	-4.22178
Coulombic:	-83.3622

Bond Count [?]

All:	32
Single:	22
Double:	10
Rotors:	9
Chiral:	1
Rigid Segments:	7

Chemical Properties

Molecular Weight:	408.451
H-Bond Donors:	4
H-Bond Acceptors:	8
XLogP:	4.28
LogP (Chemaxon):	3.83

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