Basic information
- CAS
7456-24-8- Standard SMILES
CC(CN1c2ccccc2Sc2ccc(S(=O)(=O)N(C)C)cc21)N(C)C- InChIKey
VWNWVCJGUMZDIU-UHFFFAOYSA-N- Molecular formula
- C19H25N3O2S2
- Average molar mass
- 391.6 g/mol
- Monoisotopic mass
- 391.13881904
Overview
Dimetotiazine is a member of phenothiazines.
Names & identifiers
- Preferred name
- 10-(2-(Dimethylamino)propyl)-N,N-dimethyl-10H-phenothiazine-2-sulfonamide
- IUPAC
- 10-[2-(dimethylamino)propyl]-N,N-dimethylphenothiazine-2-sulfonamide
- English name
- Dimetotiazine
- Molecular formula
- C19H25N3O2S2
- Molecular weight
- 391.557
Names & synonyms
DimetotiazineFONAZINEDimethothiazine7456-24-8DimetotiazinaDimetotiazinum10-(2-(Dimethylamino)propyl)-N,N-dimethylphenothiazine-2-sulfonamide1FTA475ZDBDTXSID6023076Phenothiazine-2-sulfonamide, 10-(2-(dimethylamino)propyl)-N,N-dimethyl-8599 R.P.IL-6302
Show more names
8599RPBayer 1483DimethodinBrn 0941549DimetothiazineDimethiotazine
10-[2-(dimethylamino)propyl]-N,N-dimethylphenothiazine-2-sulfonamideDTXCID80307610-[2-(Dimethylamino)propyl]-N,N-dimethyl-10H-phenothiazine-2-sulfonamide10-(2-(Dimethylamino)propyl)-N,N-dimethyl-10H-phenothiazine-2-sulfonamideRefChem:599591N02CX05231-229-6Dimetiotazine
Database identifiers
- CAS
7456-24-8- PubChem CID
- 3089
- DTXSID
DTXSID6023076- ChEMBL
CHEMBL346977
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 576
Physicochemical properties
- Boiling point
- 533.7 · 533.7±60.0 °C(Predicted)
- Density
- 1.1822 · 1.1822 (rough estimate)
- refractive index
- 1.656 · 1.6560 (estimate)
- pka
- 8.91 · 8.91±0.50(Predicted)
- FDA UNII
- 1 FTA475ZDB · 1FTA475ZDB
- ATC code
- 2 CX05 · N02CX05
Chemistry & industry
Pharmacology
ATC Code
N - Nervous system
QN - Nervous system
MeSH Pharmacological Classification
Drugs that selectively bind to but do not activate histamine H1 receptors, thereby blocking the actions of endogenous histamine. Included here are the classical antihistaminics that antagonize or prevent the action of histamine mainly in immediate hypersensitivity. They act in the bronchi, capillaries, and some other smooth muscles, and are used to prevent or allay motion sickness, seasonal rhinitis, and allergic dermatitis and to induce somnolence. The effects of blocking central nervous system H1 receptors are not as well understood.
Applications
UsesSerotonin inhibitor.
Upstream & downstream products
Upstream raw materials
Suppliers9 total
LGM Pharma1-(800)-881-8210 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
Related reactions
2 records
Compound notes
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