V020-8128 Screening compound: 2-{[2-ACETYL-1-(4-METHYLPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-7-YL]OXY}-N-BENZYLPROPANAMIDE

V020-8128 Screening compound: 2-{[2-ACETYL-1-(4-METHYLPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-7-YL]OXY}-N-BENZYLPROPANAMIDE
V020-8128 Screening compound: 2-{[2-ACETYL-1-(4-METHYLPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-7-YL]OXY}-N-BENZYLPROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-8128
2-{[2-ACETYL-1-(4-METHYLPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-7-YL]OXY}-N-BENZYLPROPANAMIDE

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

V020-8128

Molecular Formula

C28H30N2O3 (C28 H30 N2 O3)

Compound Name

2-{[2-ACETYL-1-(4-METHYLPHENYL)-1,2,3,4-TETRAHYDROISOQUINOLIN-7-YL]OXY}-N-BENZYLPROPANAMIDE

IUPAC name

2-{[2-acetyl-1-(4-methylphenyl)-1234-tetrahydroisoquinolin-7-yl]oxy}-N-benzylpropanamide

SMILES

CC(C(NCc1ccccc1)=O)Oc1cc(C(c2ccc(C)cc2)N(CC2)C(C)=O)c2cc1

InChI

InChI=1S/C28H30N2O3/c1-19-9-11-24(12-10-19)27-26-17-25(14-13-23(26)15-16-30(27)21(3)31)33-20(2)28(32)29-18-22-7-5-4-6-8-22/h4-14,17,20,27H,15-16,18H2,1-3H3,(H,29,32)

InChI Key

YCADFJMGLOAXNO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19916212

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.500

Distribution Coefficient, logD

4.500

Water Solubility, LogSw

-4.26

Polar Surface Area

47.803

Acid Dissociation Constant (pKa)

12.90

Base Dissociation Constant (pKb)

-1.81

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with V020-8128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-8128?
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What is the minimum amount of V020-8128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-8128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-8128
  • 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 V020-8128 available by request