200,000+ products from a single source!
sales@angenechem.com
20419-74-3 | 1H-Pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione, 7-bromo-
CAS No: 20419-74-3 Catalog No: AG0029B2 MDL No:MFCD29762840
Product Description
Catalog Number:
AG0029B2
Chemical Name:
1H-Pyrrolo[3,2-d]pyrimidine-2,4(3H,5H)-dione, 7-bromo-
CAS Number:
20419-74-3
Molecular Formula:
C6H4BrN3O2
Molecular Weight:
230.0189
MDL Number:
MFCD29762840
IUPAC Name:
7-bromo-1,5-dihydropyrrolo[3,2-d]pyrimidine-2,4-dione
InChI:
InChI=1S/C6H4BrN3O2/c7-2-1-8-4-3(2)9-6(12)10-5(4)11/h1,8H,(H2,9,10,11,12)
InChI Key:
VGTQTXDPTYNVJJ-UHFFFAOYSA-N
SMILES:
O=c1[nH]c(=O)c2c([nH]1)c(Br)c[nH]2
NSC Number:
119856
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.949g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
230.021g/mol
Monoisotopic Mass:
228.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.