G501-0425 Screening compound: N-{2-[4-(dimethylamino)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl}-2-methoxy-5-methylbenzene-1-sulfonamide

G501-0425 Screening compound: N-{2-[4-(dimethylamino)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl}-2-methoxy-5-methylbenzene-1-sulfonamide
G501-0425 Screening compound: N-{2-[4-(dimethylamino)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl}-2-methoxy-5-methylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G501-0425
N-{2-[4-(dimethylamino)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl}-2-methoxy-5-methylbenzene-1-sulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

G501-0425

Molecular Formula

C27H33N3O3S (C27 H33 N3 O3 S)

Compound Name

N-{2-[4-(dimethylamino)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl}-2-methoxy-5-methylbenzene-1-sulfonamide

IUPAC name

N-{2-[4-(dimethylamino)phenyl]-2-(1234-tetrahydroisoquinolin-2-yl)ethyl}-2-methoxy-5-methylbenzene-1-sulfonamide

SMILES

Cc(cc1)cc(S(NCC(c(cc2)ccc2N(C)C)N(CC2)Cc3c2cccc3)(=O)=O)c1OC

InChI

InChI=1S/C27H33N3O3S/c1-20-9-14-26(33-4)27(17-20)34(31,32)28-18-25(22-10-12-24(13-11-22)29(2)3)30-16-15-21-7-5-6-8-23(21)19-30/h5-14,17,25,28H,15-16,18-19H2,1-4H3/t25-/m0/s1

InChI Key

FNYDBVGGPRJKDL-VWLOTQADSA-N

MDL Number (MFCD)

MFCD08006027

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.64

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.032

Distribution Coefficient, logD

5.027

Water Solubility, LogSw

-4.60

Polar Surface Area

55.083

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

G501-0425 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G501-0425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G501-0425?
Check Price and Availability of G501-0425, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G501-0425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G501-0425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G501-0425
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of G501-0425 available by request