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Lisdexamfetamine dimesylate

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Name

Lisdexamfetamine dimesylate

EINECS 200-659-6
CAS No. 608137-33-3 Density N/A
PSA 206.64000 LogP 4.15120
Solubility N/A Melting Point N/A
Formula C15H25N3O.2(CH4O3S) Boiling Point 488 °C at 760 mmHg
Molecular Weight 455.58982 Flash Point 248.9 °C
Transport Information N/A Appearance N/A
Safety 7-16-36/37-45 Risk Codes 11-23/24/25-39/23/24/25
Molecular Structure Molecular Structure of 608137-33-3 ((2S)-2,6-DIAMINO-N-[(1S)-1-METHYL-2-PHENYLETHYL]HEXANAMIDE DIMETHANESULFONATE) Hazard Symbols F,T
Synonyms

(2S)-2,6-DIAMINO-N-[(1S)-1-METHYL-2-PHENYLETHYL]HEXANAMIDE DIMETHANESULFONATE;Lisedxamfetamine dimesylate;

 

Lisdexamfetamine dimesylate Specification

The Lisdexamfetamine dimesylate with its cas register number is 608137-33-3. It also can be called as (2S)-2,6-Diamino-N-[(1S)-1-methyl-2-phenylethyl]hexanamide dimethanesulfonate and the IUPAC Name about this chemical is (2S)-2,6-diamino-N-[(2S)-1-phenylpropan-2-yl]hexanamide; methanesulfonic acid.

Physical properties about Lisdexamfetamine dimesylate are: (1)ACD/LogP: 0.72; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 4; (4)#H bond donors: 5; (5)#Freely Rotating Bonds: 10; (6)Polar Surface Area: 26.79Å2; (7)Enthalpy of Vaporization: 75.4 kJ/mol; (8)Vapour Pressure: 1.13E-09 mmHg at 25°C.

The Lisdexamfetamine dimesylate is inactive and it can be used as a prodrug to dextroamphetamine upon cleavage of the lysine portion of the molecule. It was developed for the intention of creating a longer-lasting and more difficult to abuse version of dextroamphetamine, as the requirement of conversion into dextroamphetamine in the gastrointestinal tract increases its duration and renders it ineffective upon any other ingestion routes than the oral route.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(CC1=CC=CC=C1)NC(=O)C(CCCCN)N.CS(=O)(=O)O.CS(=O)(=O)O
(2)Isomeric SMILES: C[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CCCCN)N.CS(=O)(=O)O.CS(=O)(=O)O
(3)InChI: InChI=1S/C15H25N3O.2CH4O3S/c1-12(11-13-7-3-2-4-8-13)18-15(19)14(17)9-5-6-10-16;2*1-5(2,3)4/h2-4,7-8,12,14H,5-6,9-11,16-17H2,1H3,(H,18,19);2*1H3,(H,2,3,4)/t12-,14-;;/m0../s1
(4)InChIKey: CETWSOHVEGTIBR-FORAGAHYSA-N

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