200,000+ products from a single source!
sales@angenechem.com
126149-77-7 | 7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-amino-, methyl ester
CAS No: 126149-77-7 Catalog No: AG000RT1 MDL No:MFCD23135479
Product Description
Catalog Number:
AG000RT1
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-amino-, methyl ester
CAS Number:
126149-77-7
Molecular Formula:
C8H8N4O2
Molecular Weight:
192.1747
MDL Number:
MFCD23135479
IUPAC Name:
methyl 4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
InChI:
InChI=1S/C8H8N4O2/c1-14-8(13)4-2-10-7-5(4)6(9)11-3-12-7/h2-3H,1H3,(H3,9,10,11,12)
InChI Key:
CZYXVFNNUIUREC-UHFFFAOYSA-N
SMILES:
COC(=O)c1c[nH]c2c1c(N)ncn2
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.178g/mol
Monoisotopic Mass:
192.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.