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Chemical ID: 7514531

CN(C)c1ccc(cc1)NCc2cccc(c2OCc3ccccc3Cl)OC

Chemical ID:

7514531

Name [?]:

N'-[[2-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl]-N,N-dimethyl-benzene-1,4-diamine

SMILES [?]:

CN(C)c1ccc(cc1)NCc2cccc(c2OCc3ccccc3Cl)OC

InChi [?]:

InChI=1/C23H25ClN2O2/c1-26(2)20-13-11-19(12-14-20)25-15-17-8-6-10-22(27-3)23(17)28-16-18-7-4-5-9-21(18)24/h4-14,25H,15-16H2,1-3H3

InChi Info:

AuxInfo=1/0/N:1,3,28,22,23,14,21,13,24,15,6,8,5,9,11,19,12,20,7,4,25,16,17,26,10,2,27,18/E:(1,2)(11,12)(13,14)/rA:28nCNCCCCCCCNCCCCCCCOCCCCCCCClOC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;s12;d13;s14;d15;d12s16;s17;s18;s19;s20;d21;s22;d23;d20s24;s25;s16;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₅ClN₂O₂
All Atoms:	53
Heavy Atoms:	28
Chiral Atoms:	None

ZAP Information [?]

Total:	11.1292
Area:	618.046
Solvation:	-4.32196
Coulombic:	-36.4099

Bond Count [?]

All:	30
Single:	21
Double:	9
Rotors:	8
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.48
LogP (Chemaxon):	None

Name Annotations

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

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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

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