Name: Name:N-(5-Chloro-2-pyridinyl)-2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide
Brand: Angene
SKU: AG00CJGC
Rating: 90 (10 reviews)

N-(5-Chloro-2-pyridinyl)-2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide

CAS No.:

330942-01-3

Catalog Number:

AG00CJGC

Molecular Formula:

C21H15ClN4O3

Molecular Weight:

406.8218

Catalog Number:

AG00CJGC

Chemical Name:

N-(5-Chloro-2-pyridinyl)-2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide

CAS Number:

330942-01-3

Molecular Formula:

C21H15ClN4O3

Molecular Weight:

406.8218

MDL Number:

MFCD30537229

IUPAC Name:

N-(5-chloropyridin-2-yl)-2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide

InChI:

InChI=1S/C21H15ClN4O3/c1-29-16-7-8-18(25-20(27)14-4-2-13(11-23)3-5-14)17(10-16)21(28)26-19-9-6-15(22)12-24-19/h2-10,12H,1H3,(H,25,27)(H,24,26,28)

InChI Key:

LXFSCSJMDZZGDN-UHFFFAOYSA-N

SMILES:

COc1ccc(c(c1)C(=O)Nc1ccc(cn1)Cl)NC(=O)c1ccc(cc1)C#N

Complexity:

629

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

406.083g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

406.826g/mol

Monoisotopic Mass:

406.083g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

104A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7