Name: Name:3-((5-chloro-3-ethylpyrazolo[1,5-a]pyrimidin-7-ylamino)methyl)pyridine 1-oxide
Brand: Angene
SKU: AG00G3RI
Rating: 90 (10 reviews)

3-((5-chloro-3-ethylpyrazolo[1,5-a]pyrimidin-7-ylamino)methyl)pyridine 1-oxide

CAS No.:

779353-65-0

Catalog Number:

AG00G3RI

Molecular Formula:

C14H14ClN5O

Molecular Weight:

303.7469

Catalog Number:

AG00G3RI

Chemical Name:

3-((5-chloro-3-ethylpyrazolo[1,5-a]pyrimidin-7-ylamino)methyl)pyridine 1-oxide

CAS Number:

779353-65-0

Molecular Formula:

C14H14ClN5O

Molecular Weight:

303.7469

MDL Number:

MFCD12196871

IUPAC Name:

5-chloro-3-ethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]pyrazolo[1,5-a]pyrimidin-7-amine

InChI:

InChI=1S/C14H14ClN5O/c1-2-11-8-17-20-13(6-12(15)18-14(11)20)16-7-10-4-3-5-19(21)9-10/h3-6,8-9,16H,2,7H2,1H3

InChI Key:

AAKJCBNEUOKKTQ-UHFFFAOYSA-N

SMILES:

CCc1cnn2c1nc(Cl)cc2NCc1ccc[n+](c1)[O-]

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

303.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

303.75g/mol

Monoisotopic Mass:

303.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8