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Chemical ID: 6393288

Chemical ID:

6393288

Name [?]:

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

SMILES [?]:

Cc1ccc(cc1)c2csc(n2)NC(=O)CNC3CCCCC3

InChi [?]:

InChI=1/C18H23N3OS/c1-13-7-9-14(10-8-13)16-12-23-18(20-16)21-17(22)11-19-15-5-3-2-4-6-15/h7-10,12,15,19H,2-6,11H2,1H3,(H,20,21,22)

InChi Info:

AuxInfo=1/1/N:1,21,20,22,19,23,3,7,4,6,16,9,2,5,18,8,14,11,17,12,13,15,10/E:(3,4)(5,6)(7,8)(9,10)/rA:23nCCCCCCCCCSCNNCOCNCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s9;s10;s8d11;s11;s13;d14;s14;s16;s17;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₃N₃OS
All Atoms:	23
Heavy Atoms:	23
Chiral Atoms:	0

ZAP Information [?]

Total:	10.7976
Area:	555.277
Solvation:	-3.08429
Coulombic:	-36.1851

Bond Count [?]

All:	25
Single:	19
Double:	6
Rotors:	6
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	329.461
H-Bond Donors:	2
H-Bond Acceptors:	3
XLogP:	3.66
LogP (Chemaxon):	3.83

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