V021-6202 Screening compound: 2-({[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-phenyl-1,3-oxazole-4-carboxamide

V021-6202 Screening compound: 2-({[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-phenyl-1,3-oxazole-4-carboxamide
V021-6202 Screening compound: 2-({[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-phenyl-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6202
2-({[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-phenyl-1,3-oxazole-4-carboxamide

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

V021-6202

Molecular Formula

C30H28FN3O4 (C30 H28 FN3 O4)

Compound Name

2-({[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-phenyl-1,3-oxazole-4-carboxamide

IUPAC name

2-({[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1234-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-phenyl-13-oxazole-4-carboxamide

SMILES

CC(C)C(N(CC1)C(c(cc2)ccc2F)c2c1ccc(OCc1nc(C(Nc3ccccc3)=O)co1)c2)=O

InChI

InChI=1S/C30H28FN3O4/c1-19(2)30(36)34-15-14-20-10-13-24(16-25(20)28(34)21-8-11-22(31)12-9-21)37-18-27-33-26(17-38-27)29(35)32-23-6-4-3-5-7-23/h3-13,16-17,19,28H,14-15,18H2,1-2H3,(H,32,35)/t28-/m0/s1

InChI Key

JPJUEPPYNZJPJJ-NDEPHWFRSA-N

MDL Number (MFCD)

MFCD19917331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.506

Distribution Coefficient, logD

5.506

Water Solubility, LogSw

-5.43

Polar Surface Area

64.857

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

-2.28

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with V021-6202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6202?
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What is the minimum amount of V021-6202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6202
  • 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 V021-6202 available by request