Chemical ID: 4990091

CCN(CC)CC(=O)Nc1nccs1
Chemical ID:
4990091
Name [?]:
2-diethylamino-N-thiazol-2-yl-acetamide
SMILES [?]:
CCN(CC)CC(=O)Nc1nccs1
InChi [?]:
InChI=1/C9H15N3OS/c1-3-12(4-2)7-8(13)11-9-10-5-6-14-9/h5-6H,3-4,7H2,1-2H3,(H,10,11,13)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,12,13,6,7,10,11,9,3,8,14/E:(1,2)(3,4)/rA:14nCCNCCCCONCNCCS/rB:s1;s2;s3;s4;s3;s6;d7;s7;s9;d10;s11;d12;s10s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H15N3OS
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.46118
Area:400.208
Solvation:-3.54403
Coulombic:-29.0825
Bond Count [?]
All:14
Single:11
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:213.301
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.22
LogP (Chemaxon):1.18

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Descriptor Annotations

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