Chemical ID: 6001496

CCCCN(CC(=O)Nc1ncc(s1)C)C(=O)NC(C)(C)C
Chemical ID:
6001496
Name [?]:
2-(butyl-(tert-butylcarbamoyl)amino)-N-(5-methylthiazol-2-yl)-acetamide
SMILES [?]:
CCCCN(CC(=O)Nc1ncc(s1)C)C(=O)NC(C)(C)C
InChi [?]:
InChI=1/C15H26N4O2S/c1-6-7-8-19(14(21)18-15(3,4)5)10-12(20)17-13-16-9-11(2)22-13/h9H,6-8,10H2,1-5H3,(H,18,21)(H,16,17,20)
InChi Info:
AuxInfo=1/1/N:1,15,20,21,22,2,3,4,12,6,13,7,10,16,19,11,9,18,5,8,17,14/E:(3,4,5)/rA:22nCCCCNCCONCNCCSCCONCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;d10;s11;d12;s10s13;s13;s5;d16;s16;s18;s19;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H26N4O2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.2477
Area:565.88
Solvation:-3.89934
Coulombic:-55.2086
Bond Count [?]
All:22
Single:18
Double:4
Rotors:10
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:326.459
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:1.3
LogP (Chemaxon):1.81

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Descriptor Annotations

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