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Chemical ID: 6603156

CCOc1cc(c(cc1N2CCOCC2)OCC)NC(=O)COc3ccc(cc3)C

Chemical ID:

6603156

Name [?]:

N-(2,5-diethoxy-4-morpholino-phenyl)-2-(4-methylphenoxy)-acetamide

SMILES [?]:

CCOc1cc(c(cc1N2CCOCC2)OCC)NC(=O)COc3ccc(cc3)C

InChi [?]:

InChI=1/C23H30N2O5/c1-4-28-21-15-20(25-10-12-27-13-11-25)22(29-5-2)14-19(21)24-23(26)16-30-18-8-6-17(3)7-9-18/h6-9,14-15H,4-5,10-13,16H2,1-3H3,(H,24,26)

InChi Info:

AuxInfo=1/1/N:18,1,30,17,2,26,28,25,29,11,15,12,14,5,8,22,27,24,6,9,7,4,20,19,10,21,13,16,3,23/E:(6,7)(8,9)(10,11)(12,13)/rA:30nCCOCCCCCCNCCOCCOCCNCOCOCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;s13;s10s14;s7;s16;s17;s6;s19;d20;s20;s22;s23;s24;d25;s26;d27;d24s28;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₃₀N₂O₅
All Atoms:	30
Heavy Atoms:	30
Chiral Atoms:	0

ZAP Information [?]

Total:	9.05664
Area:	667.022
Solvation:	-7.61891
Coulombic:	-57.1676

Bond Count [?]

All:	32
Single:	25
Double:	7
Rotors:	10
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	414.495
H-Bond Donors:	1
H-Bond Acceptors:	7
XLogP:	3.6
LogP (Chemaxon):	3.44

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

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

Chemical Mix	Source	External ID	Descriptor	Value