Name: Name:7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-5-ethyl-
Brand: Angene
SKU: AG00024N
Rating: 90 (10 reviews)

7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-5-ethyl-

CAS No.:

1004992-44-2

Catalog Number:

AG00024N

Molecular Formula:

C8H8ClN3

Molecular Weight:

181.6222

Catalog Number:

AG00024N

Chemical Name:

7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-5-ethyl-

CAS Number:

1004992-44-2

Molecular Formula:

C8H8ClN3

Molecular Weight:

181.6222

MDL Number:

MFCD18375135

IUPAC Name:

4-chloro-5-ethyl-7H-pyrrolo[2,3-d]pyrimidine

InChI:

InChI=1S/C8H8ClN3/c1-2-5-3-10-8-6(5)7(9)11-4-12-8/h3-4H,2H2,1H3,(H,10,11,12)

InChI Key:

HXTUOLGGMWNTJZ-UHFFFAOYSA-N

SMILES:

CCc1c[nH]c2c1c(Cl)ncn2

Complexity:

164

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

181.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

181.623g/mol

Monoisotopic Mass:

181.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4