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Chemical ID: 4268416

Chemical ID:

4268416

Name [?]:

N-(2,5-dichlorophenyl)-2-hydroxy-benzamide

SMILES [?]:

c1ccc(c(c1)C(=O)Nc2cc(ccc2Cl)Cl)O

InChi [?]:

InChI=1/C13H9Cl2NO2/c14-8-5-6-10(15)11(7-8)16-13(18)9-3-1-2-4-12(9)17/h1-7,17H,(H,16,18)

InChi Info:

AuxInfo=1/1/N:1,2,6,3,13,14,11,12,5,15,10,4,7,17,16,9,18,8/rA:18nCCCCCCCONCCCCCCClClO/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;d11;s12;d13;d10s14;s15;s12;s4;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₃H₉Cl₂NO₂
All Atoms:	18
Heavy Atoms:	18
Chiral Atoms:	0

ZAP Information [?]

Total:	8.46364
Area:	449.464
Solvation:	-2.77297
Coulombic:	-38.9915

Bond Count [?]

All:	19
Single:	12
Double:	7
Rotors:	3
Chiral:	0
Rigid Segments:	3

Chemical Properties

Molecular Weight:	282.121
H-Bond Donors:	2
H-Bond Acceptors:	3
XLogP:	4.26
LogP (Chemaxon):	3.2

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