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Chemical ID: 6158925

Chemical ID:

6158925

Name [?]:

N-[4-(butylsulfamoyl)phenyl]-2-(2-thienyl)acetamide

SMILES [?]:

CCCCNS(=O)(=O)c1ccc(cc1)NC(=O)Cc2cccs2

InChi [?]:

InChI=1/C16H20N2O3S2/c1-2-3-10-17-23(20,21)15-8-6-13(7-9-15)18-16(19)12-14-5-4-11-22-14/h4-9,11,17H,2-3,10,12H2,1H3,(H,18,19)

InChi Info:

AuxInfo=1/1/N:1,2,3,21,20,11,13,10,14,4,22,18,12,19,9,16,5,15,17,7,8,23,6/E:(6,7)(8,9)(20,21)/CRV:23.6/rA:23nCCCCNSOOCCCCCCNCOCCCCCS/rB:s1;s2;s3;s4;s5;d6;d6;s6;s9;d10;s11;d12;d9s13;s12;s15;d16;s16;s18;d19;s20;d21;s19s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₆H₂₀N₂O₃S₂
All Atoms:	23
Heavy Atoms:	23
Chiral Atoms:	0

ZAP Information [?]

Total:	10.922
Area:	576.818
Solvation:	-3.49849
Coulombic:	-32.706

Bond Count [?]

All:	24
Single:	16
Double:	8
Rotors:	9
Chiral:	0
Rigid Segments:	6

Chemical Properties

Molecular Weight:	352.474
H-Bond Donors:	2
H-Bond Acceptors:	5
XLogP:	2.07
LogP (Chemaxon):	2.72

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