Name: Name:N-(AZA(1,3-DIOXOINDAN-2-YLIDENE)METHYL)-4-PYRIDYLFORMAMIDE
Brand: Angene
SKU: AG01EIJO
Rating: 90 (10 reviews)

N-(AZA(1,3-DIOXOINDAN-2-YLIDENE)METHYL)-4-PYRIDYLFORMAMIDE

CAS No.:

81253-04-5

Catalog Number:

AG01EIJO

Molecular Formula:

C15H9N3O3

Molecular Weight:

279.2503

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Product Description

Catalog Number:

AG01EIJO

Chemical Name:

N-(AZA(1,3-DIOXOINDAN-2-YLIDENE)METHYL)-4-PYRIDYLFORMAMIDE

CAS Number:

81253-04-5

Molecular Formula:

C15H9N3O3

Molecular Weight:

279.2503

MDL Number:

MFCD00170381

IUPAC Name:

N-[(1,3-dioxoinden-2-ylidene)amino]pyridine-4-carboxamide

InChI:

InChI=1S/C15H9N3O3/c19-13-10-3-1-2-4-11(10)14(20)12(13)17-18-15(21)9-5-7-16-8-6-9/h1-8H,(H,18,21)

InChI Key:

WBRLZIXEQFIXCQ-UHFFFAOYSA-N

SMILES:

O=C(c1ccncc1)NN=c1c(=O)c2c(c1=O)cccc2

NSC Number:

54689

Properties

Complexity:

468

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.064g/mol

Formal Charge:

Heavy Atom Count:

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Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.255g/mol

Monoisotopic Mass:

279.064g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

88.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties