Name: Name:3-{[(4-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amine
Brand: Angene
SKU: AG01E7AW
Rating: 90 (10 reviews)

3-{[(4-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amine

CAS No.:

312275-49-3

Catalog Number:

AG01E7AW

Molecular Formula:

Molecular Weight:

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG01E7AW

Chemical Name:

3-{[(4-methylphenyl)methyl]sulfanyl}-1H-1,2,4-triazol-5-amine

CAS Number:

312275-49-3

MDL Number:

MFCD03102525

IUPAC Name:

3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

InChI:

InChI=1S/C10H12N4S/c1-7-2-4-8(5-3-7)6-15-10-12-9(11)13-14-10/h2-5H,6H2,1H3,(H3,11,12,13,14)

InChI Key:

MVFRBGYNIPHBHO-UHFFFAOYSA-N

Properties

Complexity:

194

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.078g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.294g/mol

Monoisotopic Mass:

220.078g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Catalysis and inhibition of Mycobacterium tuberculosis methionine aminopeptidase.	Journal of medicinal chemistry 20100211
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties