V022-6299 Screening compound: N-({2-[(4-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)benzenesulfonamide

V022-6299 Screening compound: N-({2-[(4-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)benzenesulfonamide
V022-6299 Screening compound: N-({2-[(4-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-6299
N-({2-[(4-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)benzenesulfonamide

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

V022-6299

Molecular Formula

C25H27FN2O4S (C25 H27 FN2 O4 S)

Compound Name

N-({2-[(4-fluorophenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)benzenesulfonamide

IUPAC name

N-({2-[(4-fluorophenyl)methyl]-67-dimethoxy-1234-tetrahydroisoquinolin-1-yl}methyl)benzenesulfonamide

SMILES

COc1cc(CCN(Cc(cc2)ccc2F)C2CNS(c3ccccc3)(=O)=O)c2cc1OC

InChI

InChI=1S/C25H27FN2O4S/c1-31-24-14-19-12-13-28(17-18-8-10-20(26)11-9-18)23(22(19)15-25(24)32-2)16-27-33(29,30)21-6-4-3-5-7-21/h3-11,14-15,23,27H,12-13,16-17H2,1-2H3/t23-/m0/s1

InChI Key

ZMFYGPHUEFDLJG-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19822492

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

470.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.606

Distribution Coefficient, logD

3.572

Water Solubility, LogSw

-3.83

Polar Surface Area

60.354

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

6.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.00

V022-6299 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V022-6299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-6299?
Check Price and Availability of V022-6299, 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 V022-6299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-6299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-6299
  • 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 V022-6299 available by request