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Chemical ID: 6545881

Chemical ID:

6545881

Name [?]:

N-[(2-hydroxyphenyl)methyl]-N-(2-methoxyphenyl)-2-(2-methylphenoxy)-acetamide

SMILES [?]:

Cc1ccccc1OCC(=O)N(Cc2ccccc2O)c3ccccc3OC

InChi [?]:

InChI=1/C23H23NO4/c1-17-9-3-7-13-21(17)28-16-23(26)24(15-18-10-4-6-12-20(18)25)19-11-5-8-14-22(19)27-2/h3-14,25H,15-16H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,28,4,16,23,17,5,24,3,15,22,18,6,25,13,9,2,14,21,19,7,26,10,12,20,11,27,8/rA:28nCCCCCCCOCCONCCCCCCCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;s12;s21;d22;s23;d24;d21s25;s26;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₃NO₄
All Atoms:	28
Heavy Atoms:	28
Chiral Atoms:	0

ZAP Information [?]

Total:	7.60794
Area:	568.566
Solvation:	-6.60621
Coulombic:	-47.8832

Bond Count [?]

All:	30
Single:	20
Double:	10
Rotors:	8
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	377.433
H-Bond Donors:	1
H-Bond Acceptors:	5
XLogP:	4.26
LogP (Chemaxon):	4.35

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