Name: Name:Methyl 5-(4-broMo-2-chlorophenylaMino)-4-fluoro-1-Methyl-1H-benzo[d]iMidazole-6-carboxylate
Brand: Angene
SKU: AG00ECE9
Rating: 90 (10 reviews)

Methyl 5-(4-broMo-2-chlorophenylaMino)-4-fluoro-1-Methyl-1H-benzo[d]iMidazole-6-carboxylate

CAS No.:

606144-02-9

Catalog Number:

AG00ECE9

Molecular Formula:

C16H12BrClFN3O2

Molecular Weight:

412.6408

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

100mg

≥ 96% (HPLC)

1 week

United States

$341

- +

250mg

≥ 96% (HPLC)

1 week

United States

$643

- +

Catalog Number:

AG00ECE9

Chemical Name:

Methyl 5-(4-broMo-2-chlorophenylaMino)-4-fluoro-1-Methyl-1H-benzo[d]iMidazole-6-carboxylate

CAS Number:

606144-02-9

Molecular Formula:

C16H12BrClFN3O2

Molecular Weight:

412.6408

MDL Number:

MFCD15142594

IUPAC Name:

methyl 6-(4-bromo-2-chloroanilino)-7-fluoro-3-methylbenzimidazole-5-carboxylate

InChI:

InChI=1S/C16H12BrClFN3O2/c1-22-7-20-15-12(22)6-9(16(23)24-2)14(13(15)19)21-11-4-3-8(17)5-10(11)18/h3-7,21H,1-2H3

InChI Key:

WXGUDZJZWDZKBV-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc2n(C)cnc2c(c1Nc1ccc(cc1Cl)Br)F

Complexity:

475

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

410.979g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

412.643g/mol

Monoisotopic Mass:

410.979g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

56.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8