Name: Name:2-(CHLOROMETHYL)-5-METHYLTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE
Brand: Angene
SKU: AG00EE55
Rating: 90 (10 reviews)

2-(CHLOROMETHYL)-5-METHYLTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE

CAS No.:

568577-81-1

Catalog Number:

AG00EE55

Molecular Formula:

C8H7ClN2OS

Molecular Weight:

214.6720

Catalog Number:

AG00EE55

Chemical Name:

2-(CHLOROMETHYL)-5-METHYLTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE

CAS Number:

568577-81-1

Molecular Formula:

C8H7ClN2OS

Molecular Weight:

214.6720

MDL Number:

MFCD04115397

IUPAC Name:

2-(chloromethyl)-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one

InChI:

InChI=1S/C8H7ClN2OS/c1-4-3-13-8-6(4)7(12)10-5(2-9)11-8/h3H,2H2,1H3,(H,10,11,12)

InChI Key:

NPCDJJHBOSYDKS-UHFFFAOYSA-N

SMILES:

ClCc1nc2scc(c2c(=O)[nH]1)C

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

213.997g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.667g/mol

Monoisotopic Mass:

213.997g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

69.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7