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ML382

CAT: 0013-GTR19157800-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19157800-01Size:200 mg
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Description
ML382 is a potent and selective MrgX1 positive allosteric modulator (EC50 : 190 nM) .ML382 enhances the ability of BAM8-22 to inhibit high-voltage-activated Ca2+ channels and attenuate spinal nociceptive transmission, both BAM8-22 and ML382 effectively attenuated evoked, persistent, and spontaneous pain without causing obvious side effects. Notably, ML382 by itself attenuated both evoked pain hypersensitivity and spontaneous pain in MrgprX1 mice after nerve injury without acquiring coadministration of an exogenous agonist.
CAS Number
1646499-97-9
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 100 mg/mL (277.45 mM)
Smiles
CCOc1ccccc1NC (=O) c1ccccc1NS (=O) (=O) C1CC1
Molecular Formula
C??H??NO?
Molecular Weight
360.42
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

2-(Cyclopropanesulfonamido)-N-(2-ethoxyphenyl)benzamide
CAS Number1646499-97-9
PubChem CID71598556
IUPAC Name2-(cyclopropylsulfonylamino)-N-(2-ethoxyphenyl)benzamide
Molecular FormulaC18H20N2O4S
Molecular Weight360.4
XLogP3.2
Topological Polar Surface Area92.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count25
Formal Charge0
Complexity556
SMILES
CCOC1=CC=CC=C1NC(=O)C2=CC=CC=C2NS(=O)(=O)C3CC3
InChI
InChI=1S/C18H20N2O4S/c1-2-24-17-10-6-5-9-16(17)19-18(21)14-7-3-4-8-15(14)20-25(22,23)13-11-12-13/h3-10,13,20H,2,11-12H2,1H3,(H,19,21)
InChIKey
RCSLEKLNDJJJLF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Cyclopropanesulfonamido)-N-(2-ethoxyphenyl)benzamide
CAS: 1646499-97-9
CID: 71598556
Formula: C18H20N2O4S
MW: 360.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight360.4
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass360.11437830
Monoisotopic Mass360.11437830
Topological Polar Surface Area92.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity556
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
562786ML382
A22168-200ML382 200mg
A22168-50ML382 50mg
A22168-25ML382 25mg
A22168-10ML382 10mg
A22168-100ML382 100mg
A22168-5ML382 5mg
A22168-10mM-DML382 10mM * 1mL in DMSO
TBI3937-10MGML382, MRGPRX1 positive allosteric modulator

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