Name: Name:1-[(2-Hydroxyethyl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Brand: Angene
SKU: AG0030G9
Rating: 90 (10 reviews)

1-[(2-Hydroxyethyl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile

CAS No.:

305331-46-8

Catalog Number:

AG0030G9

Molecular Formula:

C15H14N4O

Molecular Weight:

266.2979

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

95%

In Stock USA

United States

$96

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95%

In Stock USA

United States

$216

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Product Description

Catalog Number:

AG0030G9

Chemical Name:

1-[(2-Hydroxyethyl)amino]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile

CAS Number:

305331-46-8

Molecular Formula:

C15H14N4O

Molecular Weight:

266.2979

MDL Number:

MFCD00656716

IUPAC Name:

1-(2-hydroxyethylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile

InChI:

InChI=1S/C15H14N4O/c1-10-8-14(17-6-7-20)19-13-5-3-2-4-12(13)18-15(19)11(10)9-16/h2-5,8,17,20H,6-7H2,1H3

InChI Key:

AFGZYQZNQMEOPY-UHFFFAOYSA-N

SMILES:

OCCNc1cc(C)c(c2n1c1ccccc1n2)C#N

NSC Number:

712425

Properties

Complexity:

393

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.117g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.304g/mol

Monoisotopic Mass:

266.117g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9

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