Name: Name:1H-Purine-2,6-dione, 7-(3-bromopropyl)-3,7-dihydro-1,3-dimethyl-
Brand: Angene
SKU: AG002MDG
Rating: 90 (10 reviews)

1H-Purine-2,6-dione, 7-(3-bromopropyl)-3,7-dihydro-1,3-dimethyl-

CAS No.:

23146-06-7

Catalog Number:

AG002MDG

Molecular Formula:

C10H13BrN4O2

Molecular Weight:

301.1398

Catalog Number:

AG002MDG

Chemical Name:

1H-Purine-2,6-dione, 7-(3-bromopropyl)-3,7-dihydro-1,3-dimethyl-

CAS Number:

23146-06-7

Molecular Formula:

C10H13BrN4O2

Molecular Weight:

301.1398

MDL Number:

MFCD03237255

IUPAC Name:

7-(3-bromopropyl)-1,3-dimethylpurine-2,6-dione

InChI:

InChI=1S/C10H13BrN4O2/c1-13-8-7(9(16)14(2)10(13)17)15(6-12-8)5-3-4-11/h6H,3-5H2,1-2H3

InChI Key:

IXYPCFPAFIVIGP-UHFFFAOYSA-N

SMILES:

BrCCCn1cnc2c1c(=O)n(C)c(=O)n2C

EC Number:

245-455-8

Complexity:

338

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

300.022g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

301.144g/mol

Monoisotopic Mass:

300.022g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6