Chemical ID: 6001270

CCCCCC(=O)N(CC(=O)Nc1ncc(s1)C)C(C)C
Chemical ID:
6001270
Name [?]:
N-isopropyl-N-[(5-methylthiazol-2-yl)carbamoylmethyl]hexanamide
SMILES [?]:
CCCCCC(=O)N(CC(=O)Nc1ncc(s1)C)C(C)C
InChi [?]:
InChI=1/C15H25N3O2S/c1-5-6-7-8-14(20)18(11(2)3)10-13(19)17-15-16-9-12(4)21-15/h9,11H,5-8,10H2,1-4H3,(H,16,17,19)
InChi Info:
AuxInfo=1/1/N:1,20,21,18,2,3,4,5,15,9,19,16,10,6,13,14,12,8,11,7,17/E:(2,3)/rA:21nCCCCCCONCCONCNCCSCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;d10;s10;s12;d13;s14;d15;s13s16;s16;s8;s19;s19;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H25N3O2S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.69883
Area:546.74
Solvation:-3.96967
Coulombic:-40.8067
Bond Count [?]
All:21
Single:17
Double:4
Rotors:10
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:311.444
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.86
LogP (Chemaxon):2.37

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