Name: Name:ethyl 6-(chloromethyl)-4-(furan-2-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Brand: Angene
SKU: AG019OH7
Rating: 90 (10 reviews)

ethyl 6-(chloromethyl)-4-(furan-2-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

CAS No.:

585516-41-2

Catalog Number:

AG019OH7

Molecular Formula:

C12H13ClN2O4

Molecular Weight:

284.6956

Catalog Number:

AG019OH7

Chemical Name:

ethyl 6-(chloromethyl)-4-(furan-2-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

CAS Number:

585516-41-2

Molecular Formula:

C12H13ClN2O4

Molecular Weight:

284.6956

MDL Number:

MFCD03030347

IUPAC Name:

ethyl 6-(chloromethyl)-4-(furan-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate

InChI:

InChI=1S/C12H13ClN2O4/c1-2-18-11(16)9-7(6-13)14-12(17)15-10(9)8-4-3-5-19-8/h3-5,10H,2,6H2,1H3,(H2,14,15,17)

InChI Key:

XHNONBRRPYWXOS-UHFFFAOYSA-N

SMILES:

CCOC(=O)C1=C(CCl)NC(=O)NC1c1ccco1

Complexity:

411

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

284.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

284.696g/mol

Monoisotopic Mass:

284.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5