5-Methoxy[1,3]thiazolo[5,4-b]pyridin-2-amine

HCID 2801557CAS 13797-77-8

Substructure search Find similar structures

Basic information

Standard SMILES: COc1ccc2nc(N)sc2n1
InChIKey: LLPVJZMTIYQTGU-UHFFFAOYSA-N
Molecular formula: C7H7N3OS
Average molar mass: 181.22 g/mol
Monoisotopic mass: 181.03098284

Names & identifiers

Preferred name: 5-Methoxy[1,3]thiazolo[5,4-b]pyridin-2-amine
IUPAC: 5-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-amine
English name: 5-METHOXYPYRIDOó3,2-D]ó1,3]THIAZOL-2-AMINE,97%
Molecular formula: C7H7N3OS
Molecular weight: 181.21

Names & synonyms

13797-77-85-Methoxy[1,3]thiazolo[5,4-b]pyridin-2-amineDTXSID603842725-Methoxy(1,3)thiazolo(5,4-b)pyridin-2-amineRefChem:303642DTXCID30335296836-492-65-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-amine5-METHOXYTHIAZOLO[5,4-B]PYRIDIN-2-AMINEThiazolo[5,4-b]pyridin-2-amine, 5-methoxy-MFCD001005555-METHOXY-THIAZOLO[5,4-B]PYRIDIN-2-YLAMINE

Show more names

5-methoxy-2-thiazolo[5,4-b]pyridinamine5-METHOXY-THIAZOLO[5,4-B]PYRIDINE-2-AMINE5-METHOXYPYRIDOó3,2-D]ó1,3]THIAZOL-2-AMINE5-METHOXYPYRIDOó3,2-D]ó1,3]THIAZOL-2-AMINE,97%

5-methoxypyrido[3,2-d][1,3]thiazol-2-amine5-Methoxythiazolo[5,4-b]pyridine-2-amine5-METHOXYPYRIDOo3,2-D]o1,3]THIAZOL-2-AMINE,97per centMaybridge1_002128Oprea1_707698SCHEMBL184747SCHEMBL26423342-AMINO-5-METHOXYPYRIDO[3,2-D][1,3]THIAZOLE

Database identifiers

CAS: 13797-77-8
PubChem CID: 2801557
DTXSID: DTXSID60384272
EC Number: 836-492-6

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 89.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 169

Physicochemical properties

Melting point: 192 · 192-193 °C
Boiling point: 335.1 · 335.1±45.0 °C(Predicted)
Density: 1.44 · 1.440±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, protect from light
pka: 4.05 · 4.05±0.50(Predicted)
form: solid
color: Purple
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
HS Code: 2921290090 · 2921290090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.