5-Bromo-2-(2-methyl-2H-tetrazol-5-yl)-pyridine - CAS 380380-64-3

Name: 5-Bromo-2-(2-methyl-2H-tetrazol-5-yl)-pyridine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB023498
Product Name:	5-Bromo-2-(2-methyl-2H-tetrazol-5-yl)-pyridine
CAS:	380380-64-3
Synonyms:	5-bromo-2-(2-methyl-5-tetrazolyl)pyridine; 5-bromo-2-(2-methyltetrazol-5-yl)pyridine

Technical Data

IUPAC Name:	5-bromo-2-(2-methyltetrazol-5-yl)pyridine
Description:	5-Bromo-2-(2-methyl-2H-tetrazol-5-yl)-pyridine (CAS# 380380-64-3) is a reagent in the synthesis and structure-activity relationship studies of highly potent novel benzoxazinyl-oxazolidinone which is an antibacterial agent. Benzoxazinyl-oxazolidinone had potent activity against Gram-positive pathogens. 5-Bromo-2-(2-methyl-2H-tetrazol-5-yl)pyridine is also an intermediate in the synthesis of Tedizolid (T013750).
Molecular Weight:	240.06
Molecular Formula:	C7H6BrN5
Canonical SMILES:	CN1N=C(N=N1)C2=NC=C(C=C2)Br
InChI:	InChI=1S/C7H6BrN5/c1-13-11-7(10-12-13)6-3-2-5(8)4-9-6/h2-4H,1H3
InChI Key:	JANKGNBDRWYWSN-UHFFFAOYSA-N
Boiling Point:	375.19 °C at 760 mmHg
Purity:	95 %
Density:	1.853 g/cm³
MDL:	MFCD06796604
LogP:	1.03460

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-113248471-A	Preparation method of zolamide drug intermediate and intermediate thereof	20210705
CN-113248471-B	Preparation method of zolamide drug intermediate and intermediate thereof	20210705
CN-113354620-A	Efficient preparation method of tedizolid intermediate and intermediate thereof	20210705
CN-111285848-A	Purification method of 5-bromo-2- (2-methyl-2H-tetrazole-5-yl) pyridine	20200410
WO-2021130257-A1	Dihydro-cyclopenta-isoquinoline sulfonamides derivatives	20191223

Complexity:	178
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	238.98066
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	238.98066
Rotatable Bond Count:	1
Topological Polar Surface Area:	56.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4