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1016521-32-6

1016521-32-6 | 1-(4-methyl-1,3-thiazole-5-carbonyl)-1,4-diazepane

CAS No: 1016521-32-6 Catalog No: AG019WPY MDL No:MFCD09808231

Product Description

Catalog Number:
AG019WPY
Chemical Name:
1-(4-methyl-1,3-thiazole-5-carbonyl)-1,4-diazepane
CAS Number:
1016521-32-6
Molecular Formula:
C10H15N3OS
Molecular Weight:
225.3106
MDL Number:
MFCD09808231
IUPAC Name:
1,4-diazepan-1-yl-(4-methyl-1,3-thiazol-5-yl)methanone
InChI:
InChI=1S/C10H15N3OS/c1-8-9(15-7-12-8)10(14)13-5-2-3-11-4-6-13/h7,11H,2-6H2,1H3
InChI Key:
IHAJOFVLYMGMGV-UHFFFAOYSA-N
SMILES:
Cc1ncsc1C(=O)N1CCNCCC1

Properties

Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.094g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.31g/mol
Monoisotopic Mass:
225.094g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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