Home Halogens (R)-2-chloro-7-ethyl-8-isopropyl-7,8-dihydropteridin-6(5H)-one

(R)-2-chloro-7-ethyl-8-isopropyl-7,8-dihydropteridin-6(5H)-one

CAS No.:
889877-77-4
Catalog Number:
AG00GYH8
Molecular Formula:
C11H15ClN4O
Molecular Weight:
254.7160
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Product Description
Catalog Number:
AG00GYH8
Chemical Name:
(R)-2-chloro-7-ethyl-8-isopropyl-7,8-dihydropteridin-6(5H)-one
CAS Number:
889877-77-4
Molecular Formula:
C11H15ClN4O
Molecular Weight:
254.7160
MDL Number:
MFCD16620521
IUPAC Name:
(7R)-2-chloro-7-ethyl-8-propan-2-yl-5,7-dihydropteridin-6-one
InChI:
InChI=1S/C11H15ClN4O/c1-4-8-10(17)14-7-5-13-11(12)15-9(7)16(8)6(2)3/h5-6,8H,4H2,1-3H3,(H,14,17)/t8-/m1/s1
InChI Key:
HZKCDOWKVNPXCW-MRVPVSSYSA-N
SMILES:
CC[C@@H]1C(=O)Nc2c(N1C(C)C)nc(nc2)Cl
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
254.093g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.718g/mol
Monoisotopic Mass:
254.093g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties