Chemical ID: 6354435

Cc1c(sc(n1)NC(=O)C(C)C)C
Chemical ID:
6354435
Name [?]:
N-(4,5-dimethylthiazol-2-yl)-2-methyl-propanamide
SMILES [?]:
Cc1c(sc(n1)NC(=O)C(C)C)C
InChi [?]:
InChI=1/C9H14N2OS/c1-5(2)8(12)11-9-10-6(3)7(4)13-9/h5H,1-4H3,(H,10,11,12)
InChi Info:
AuxInfo=1/1/N:11,12,1,13,10,2,3,8,5,6,7,9,4/E:(1,2)/rA:13nCCCSCNNCOCCCC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;s10;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H14N2OS
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.97571
Area:374.902
Solvation:-2.39684
Coulombic:-24.6123
Bond Count [?]
All:13
Single:10
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:198.286
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.79
LogP (Chemaxon):1.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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