Prochlorperazine hydrogen methanesulfonate
Basic information
- CAS
3111-70-4- Standard SMILES
CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1.CS(=O)(=O)O- InChIKey
WLFCZUKGFJNFQY-UHFFFAOYSA-N- Molecular formula
- C21H28ClN3O3S2
- Average molar mass
- 470.1 g/mol
- Monoisotopic mass
- 469.1260618
Overview
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Names & identifiers
- Preferred name
- Prochlorperazine hydrogen methanesulfonate
- IUPAC
- 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine;methanesulfonic acid
- English name
- 2-chloro-10-[3-(4-methyl-1-piperazinyl)propyl]-10H-phenothiazine monomethanesulphonate
- Molecular formula
- C21H28ClN3O3S2
- Molecular weight
- 470.04832
Names & synonyms
Prochlorperazine hydrogen methanesulfonateDTXSID70185050RefChem:1096622DTXCID801075413111-70-4Prochlorperazine mesylate2-chloro-10-[3-(4-methyl-1-piperazinyl)propyl]-10H-phenothiazine monomethanesulphonate2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-10H-phenothiazine monomethanesulphonateEINECS 221-473-177KYK55QHXPhenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-, hydrogen methanesulfonatePiperazine, 1-methyl-4-(3-(2-chloro-phenothiazin-10-yl)propyl)-, hydrogen methanesulfonate
Show more names
Prochlorperazine MethanesulfonicSCHEMBL1527298WLFCZUKGFJNFQY-UHFFFAOYSA-NProchlorperazine monomethanesulphonateProchlorperazine Mesylate - API StandardsNS0008207610H-Phenothiazine, 2-chloro-10-[3-(4-methyl-1-piperazinyl)propyl]-, methanesulfonate (1:1)Methanesulfonic acid--2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine (1/1)
Database identifiers
- CAS
Properties
Computed structural properties
- Topological polar surface area
- 97.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 522
Physicochemical properties
- EWG's Food Scores
- 1 · 1
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Related reactions
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Compound notes
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