Home Halogens 3-chloro-5-(cyclopentylamino)-1,2-thiazole-4-carbonitrile

3-chloro-5-(cyclopentylamino)-1,2-thiazole-4-carbonitrile

CAS No.:
1424533-72-1
Catalog Number:
AG01AFLX
Molecular Formula:
C9H10ClN3S
Molecular Weight:
227.7138
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Product Description
Catalog Number:
AG01AFLX
Chemical Name:
3-chloro-5-(cyclopentylamino)-1,2-thiazole-4-carbonitrile
CAS Number:
1424533-72-1
Molecular Formula:
C9H10ClN3S
Molecular Weight:
227.7138
MDL Number:
MFCD29762576
IUPAC Name:
3-chloro-5-(cyclopentylamino)-1,2-thiazole-4-carbonitrile
InChI:
InChI=1S/C9H10ClN3S/c10-8-7(5-11)9(14-13-8)12-6-3-1-2-4-6/h6,12H,1-4H2
InChI Key:
MHEGQORSOWZPOZ-UHFFFAOYSA-N
SMILES:
N#Cc1c(Cl)nsc1NC1CCCC1
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.71g/mol
Monoisotopic Mass:
227.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties