Chemical ID: 6216146

Cc1c(sc(n1)NC(=O)C(C)C)C(=O)C
Chemical ID:
6216146
Name [?]:
N-(5-acetyl-4-methyl-thiazol-2-yl)-2-methyl-propanamide
SMILES [?]:
Cc1c(sc(n1)NC(=O)C(C)C)C(=O)C
InChi [?]:
InChI=1/C10H14N2O2S/c1-5(2)9(14)12-10-11-6(3)8(15-10)7(4)13/h5H,1-4H3,(H,11,12,14)
InChi Info:
AuxInfo=1/1/N:11,12,1,15,10,2,13,3,8,5,6,7,14,9,4/E:(1,2)/rA:15nCCCSCNNCOCCCCOC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;s10;s3;d13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H14N2O2S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.87679
Area:404.079
Solvation:-3.22518
Coulombic:-31.6202
Bond Count [?]
All:15
Single:11
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:226.296
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.37
LogP (Chemaxon):1.05

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Descriptor Annotations

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