Home Carboxys 4-(Cyclopentylamino)-2-(methylthio)pyrimidine-5-carboxylic acid

4-(Cyclopentylamino)-2-(methylthio)pyrimidine-5-carboxylic acid

CAS No.:
1065075-68-4
Catalog Number:
AG00HATS
Molecular Formula:
C11H15N3O2S
Molecular Weight:
253.3207
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$399
- +
1g
95%
1 week
United States
$942
- +
Product Description
Catalog Number:
AG00HATS
Chemical Name:
4-(Cyclopentylamino)-2-(methylthio)pyrimidine-5-carboxylic acid
CAS Number:
1065075-68-4
Molecular Formula:
C11H15N3O2S
Molecular Weight:
253.3207
MDL Number:
MFCD11100923
IUPAC Name:
4-(cyclopentylamino)-2-methylsulfanylpyrimidine-5-carboxylic acid
InChI:
InChI=1S/C11H15N3O2S/c1-17-11-12-6-8(10(15)16)9(14-11)13-7-4-2-3-5-7/h6-7H,2-5H2,1H3,(H,15,16)(H,12,13,14)
InChI Key:
GZXJDOFLCMEPGA-UHFFFAOYSA-N
SMILES:
CSc1ncc(c(n1)NC1CCCC1)C(=O)O
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.088g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.32g/mol
Monoisotopic Mass:
253.088g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties