1-(2,6-Dimethylphenyl)-3-(imino(methylamino)methyl)uronium chloride
Basic information
- CAS
65009-35-0- Standard SMILES
CN=C(N)NC(=O)Nc1c(C)cccc1C.Cl- InChIKey
INMBONSHXVMDSX-UHFFFAOYSA-N- Molecular formula
- C11H17ClN4O
- Average molar mass
- 256.73 g/mol
- Monoisotopic mass
- 256.1090889
Names & identifiers
- Preferred name
- 1-(2,6-Dimethylphenyl)-3-(imino(methylamino)methyl)uronium chloride
- IUPAC
- 1-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea;hydrochloride
- English name
- Lidamidine Hydrochloride
- Molecular formula
- C11H17ClN4O
- Molecular weight
- 256.73188
Names & synonyms
1-(2,6-Dimethylphenyl)-3-(imino(methylamino)methyl)uronium chloride1-(2,6-dimethylphenyl)-3-[imino(methylamino)methyl]uronium chlorideRefChem:420683LIDAMIDINE HYDROCHLORIDE65009-35-0Lidamidine HClWHR-1142ALidamidine hydrochloride [USAN]1-(2,6-Dimethylphenyl)-3-methylamidinourea hydrochlorideLidamidine (hydrochloride)1-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea;hydrochloride3Q1Q4QJV3V
Show more names
LidaralYM-11256Unii-3Q1Q4qjv3vAdagrasib Impurity 6Lidamidium HydrochlorideLidamidine monohydrochlorideLIDAMIDINE(LIDAMIDIUM) HYDROCHLORIDE
1-(Methylamidino)-3-(2,6-xylyl)urea monohydrochloride66283-88-31-(2,6-dimethylphenyl)-3-(N'-methylcarbamimidoyl)urea hydrochlorideLidarralSmodinUrea, N-(2,6-dimethylphenyl)-N'-(imino(methylamino)methyl)-, monohydrochlorideLidamidine hydrochloride (USAN)EINECS 265-307-6
Database identifiers
- CAS
65009-35-0、66283-88-3- PubChem CID
- 47509
- DTXSID
DTXSID10983557- ChEMBL
CHEMBL1490570- UNII
- 3Q1Q4QJV3V
- EC Number
- 265-307-6、266-299-7
Properties
Computed structural properties
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 267
Experimental & physicochemical properties
Solubility>38.5 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 194 · 194-197°
- FDA UNII
- 3 Q1Q4QJV3V · 3Q1Q4QJV3V
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501
- Toxicity
- 50 in · LD50 in male mice, male, female rats (mg/kg): 260, 267, 160 orally; in mice (mg/kg): 56 i.v. (Chou)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Toxicity
- LD50 in male mice, male, female rats (mg/kg): 260, 267, 160 orally; in mice (mg/kg): 56 i.v. (Chou)
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Applications
DescriptionLidamidine hydrochloride is an antiperistaltic agent which appears to act by interfering with the availability of calcium necessary for excitation-contraction coupling in smooth muscle. It is useful in the treatment of diarrhea of various origins.
UsesAntiperistaltic.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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