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Chemical ID: 7484125

Cc1ccc(cc1NC(=O)CCCCCCCC(=O)Nc2cc(ccc2C)Cl)Cl

Chemical ID:

7484125

Name [?]:

N,N'-bis(5-chloro-2-methyl-phenyl)nonanediamide

SMILES [?]:

Cc1ccc(cc1NC(=O)CCCCCCCC(=O)Nc2cc(ccc2C)Cl)Cl

InChi [?]:

InChI=1/C23H28Cl2N2O2/c1-16-10-12-18(24)14-20(16)26-22(28)8-6-4-3-5-7-9-23(29)27-21-15-19(25)13-11-17(21)2/h10-15H,3-9H2,1-2H3,(H,26,28)(H,27,29)

InChi Info:

AuxInfo=1/1/N:1,27,14,13,15,12,16,11,17,3,25,4,24,6,22,2,26,5,23,7,21,9,18,29,28,8,20,10,19/E:(1,2)(4,5)(6,7)(8,9)(10,11)(12,13)(14,15)(16,17)(18,19)(20,21)(22,23)(24,25)(26,27)(28,29)/gE:(1,2)/rA:29nCCCCCCCNCOCCCCCCCCONCCCCCCCClCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;s13;s14;s15;s16;s17;d18;s18;s20;s21;d22;s23;d24;d21s25;s26;s23;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₈Cl₂N₂O₂
All Atoms:	57
Heavy Atoms:	29
Chiral Atoms:	0

ZAP Information [?]

Total:	14.6137
Area:	720.201
Solvation:	-3.39129
Coulombic:	-42.0724

Bond Count [?]

All:	30
Single:	22
Double:	8
Rotors:	12
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	435.386
H-Bond Donors:	2
H-Bond Acceptors:	4
XLogP:	6.12
LogP (Chemaxon):	5.36

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

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

Chemical Mix	Source	External ID	Descriptor	Value