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SB-269970 hydrochloride

CAT: 0931-T6655-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T6655-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
261901-57-9
Target
5-HT Receptor
Related Pathways
GPCR/G Protein, Neuroscience
Purity
0.998
Bioactivity
SB-269970 hydrochloride (SB-269970A), a hydrochloride salt form of SB-269970, is a 5-HT7 receptor antagonist (pKi of 8.3) and exhibits >50-fold selectivity against other receptors.
Smiles
Cl.CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1
Molecular Formula
C18H28N2O3S·HCl
Molecular Weight
388.95
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(R)-3-((2-(2-(4-Methylpiperidin-1-yl)ethyl)pyrrolidin-1-yl)sulfonyl)phenol hydrochloride

SB-269970 hydrochloride is an organic molecular entity. It has a role as a serotonergic antagonist.

CAS Number261901-57-9
PubChem CID11957684
IUPAC Name3-[(2R)-2-[2-(4-methylpiperidin-1-yl)ethyl]pyrrolidin-1-yl]sulfonylphenol;hydrochloride
Molecular FormulaC18H29ClN2O3S
Molecular Weight389.0
Topological Polar Surface Area69.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity497
SMILES
CC1CCN(CC1)CC[C@H]2CCCN2S(=O)(=O)C3=CC=CC(=C3)O.Cl
InChI
InChI=1S/C18H28N2O3S.ClH/c1-15-7-11-19(12-8-15)13-9-16-4-3-10-20(16)24(22,23)18-6-2-5-17(21)14-18;/h2,5-6,14-16,21H,3-4,7-13H2,1H3;1H/t16-;/m1./s1
InChIKey
XQCJOYZLWFNDIO-PKLMIRHRSA-N
Chemical Structure
2D Structure
2D structure of (R)-3-((2-(2-(4-Methylpiperidin-1-yl)ethyl)pyrrolidin-1-yl)sulfonyl)phenol hydrochloride
CAS: 261901-57-9
CID: 11957684
Formula: C18H29ClN2O3S
MW: 389.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight389.0
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass388.1587417
Monoisotopic Mass388.1587417
Topological Polar Surface Area69.2 Ų
Heavy Atom Count25
Formal Charge0
Complexity497
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

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1612/50SB 269970 hydrochloride
sc-255605SB-269970 hydrochloride
HY-15370A-01SB-269970 (hydrochloride)
A21889-5SB-269970 hydrochloride 5mg
A21889-50SB-269970 hydrochloride 50mg
A21889-25SB-269970 hydrochloride 25mg
A21889-10SB-269970 hydrochloride 10mg
A21889-100SB-269970 hydrochloride 100mg
A21889-1SB-269970 hydrochloride 1mg
A21889-10mM-DSB-269970 hydrochloride 10mM * 1mL in DMSO

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