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Chemical ID: 4152461

Cc1ccc(cc1)c2csc(n2)NC(=O)COc3ccc(cc3)c4ccccc4

Chemical ID:

4152461

Name [?]:

2-(4-phenylphenoxy)-N-[4-(p-tolyl)thiazol-2-yl]-acetamide

SMILES [?]:

Cc1ccc(cc1)c2csc(n2)NC(=O)COc3ccc(cc3)c4ccccc4

InChi [?]:

InChI=1/C24H20N2O2S/c1-17-7-9-20(10-8-17)22-16-29-24(25-22)26-23(27)15-28-21-13-11-19(12-14-21)18-5-3-2-4-6-18/h2-14,16H,15H2,1H3,(H,25,26,27)

InChi Info:

AuxInfo=1/1/N:1,27,26,28,25,29,3,7,4,6,20,22,19,23,16,9,2,24,21,5,18,8,14,11,12,13,15,17,10/E:(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/rA:29nCCCCCCCCCSCNNCOCOCCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s9;s10;s8d11;s11;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s21;s24;d25;s26;d27;d24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₀N₂O₂S
All Atoms:	29
Heavy Atoms:	29
Chiral Atoms:	0

ZAP Information [?]

Total:	11.2483
Area:	646.709
Solvation:	-4.9194
Coulombic:	-36.6696

Bond Count [?]

All:	32
Single:	20
Double:	12
Rotors:	7
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	400.494
H-Bond Donors:	1
H-Bond Acceptors:	3
XLogP:	5.89
LogP (Chemaxon):	6.37

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