2-(4-(Chloromethyl)thiazol-2-YL)guanidine

HCID 178512677CAS 81152-53-6
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Basic information

Standard SMILES
N=C(N)Nc1nc(CCl)cs1
InChIKey
LUUXKXPRQLQHQR-UHFFFAOYSA-N
Molecular formula
C5H7ClN4S
Average molar mass
190.66 g/mol
Monoisotopic mass
190.0079951

Names & identifiers

Preferred name
2-(4-(Chloromethyl)thiazol-2-YL)guanidine
IUPAC
2-[4-(chloromethyl)-1,3-thiazol-2-yl]guanidine
English name
2-(4-(CHLOROMETHYL)THIAZOL-2-YL)GUANIDINE
Molecular formula
C5H7ClN4S
Molecular weight
190.65

Names & synonyms

81152-53-62-(4-(CHLOROMETHYL)THIAZOL-2-YL)GUANIDINEDTXSID60408260RefChem:251853DTXCID103591122-[4-(chloromethyl)-1,3-thiazol-2-yl]guanidine1-(4-(chloromethyl)thiazol-2-yl)guanidineFamotidine Impurity 20Famotidine Impurity 02Famotidine Impurity 82Guanidine, N-[4-(chloromethyl)-2-thiazolyl]-6ZT7F7UX4M
Show more names
Famotidine Impurity 14Famotidine Chloromethyl Impurity1-(4-(CHLOROMETHYL)THIAZOL-2-YL)GUANIDIN
SCHEMBL6508131SCHEMBL10776417AKOS006285507AB44001N-[4-(Chloromethyl)-2-thiazolyl]guanidineGuanidine, [4-(chloromethyl)-2-thiazolyl]-C90548N''-[4-(CHLOROMETHYL)-1,3-THIAZOL-2-YL]GUANIDINE

Database identifiers

CAS
81152-53-6
PubChem CID
5095891

Properties

Computed structural properties

XLogP
0.2
Topological polar surface area
106 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Boiling point
340 · 340.0±34.0 °C(Predicted)
Density
1.71 · 1.71±0.1 g/cm3(Predicted)
pka
8.38 · 8.38±0.70(Predicted)
FDA UNII
6 ZT7F7UX4M · 6ZT7F7UX4M

Chemistry & industry

Upstream & downstream products

Suppliers15 total

济南百隆化学有限公司[email protected] · [email protected]
武汉卓元易创科技有限公司13476791851 13476791851 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]

Related reactions

4 records
New reaction record

Linked notes

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