Name: Name:methyl 2-[(chloroacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate
Brand: Angene
SKU: AG00JBTQ
Rating: 90 (10 reviews)

methyl 2-[(chloroacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate

CAS No.:

519016-66-1

Catalog Number:

AG00JBTQ

Molecular Formula:

C14H11ClFNO3S

Molecular Weight:

327.7584

Catalog Number:

AG00JBTQ

Chemical Name:

methyl 2-[(chloroacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate

CAS Number:

519016-66-1

Molecular Formula:

C14H11ClFNO3S

Molecular Weight:

327.7584

MDL Number:

MFCD02853996

IUPAC Name:

methyl 2-[(2-chloroacetyl)amino]-4-(4-fluorophenyl)thiophene-3-carboxylate

InChI:

InChI=1S/C14H11ClFNO3S/c1-20-14(19)12-10(8-2-4-9(16)5-3-8)7-21-13(12)17-11(18)6-15/h2-5,7H,6H2,1H3,(H,17,18)

InChI Key:

CGQBNNFYYWPXPR-UHFFFAOYSA-N

SMILES:

COC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)CCl

Complexity:

390

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

327.013g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

327.754g/mol

Monoisotopic Mass:

327.013g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9