V020-9979 Screening compound: 2-({[(4-fluorophenyl)methyl][(2-methylphenyl)methyl]amino}methyl)-N-(1-phenylethyl)-1,3-oxazole-4-carboxamide

V020-9979 Screening compound: 2-({[(4-fluorophenyl)methyl][(2-methylphenyl)methyl]amino}methyl)-N-(1-phenylethyl)-1,3-oxazole-4-carboxamide
V020-9979 Screening compound: 2-({[(4-fluorophenyl)methyl][(2-methylphenyl)methyl]amino}methyl)-N-(1-phenylethyl)-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-9979
2-({[(4-fluorophenyl)methyl][(2-methylphenyl)methyl]amino}methyl)-N-(1-phenylethyl)-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

V020-9979

Molecular Formula

C28H28FN3O2 (C28 H28 FN3 O2)

Compound Name

2-({[(4-fluorophenyl)methyl][(2-methylphenyl)methyl]amino}methyl)-N-(1-phenylethyl)-1,3-oxazole-4-carboxamide

IUPAC name

2-({[(4-fluorophenyl)methyl][(2-methylphenyl)methyl]amino}methyl)-N-(1-phenylethyl)-13-oxazole-4-carboxamide

SMILES

CC(c1ccccc1)NC(c1coc(CN(Cc(cc2)ccc2F)Cc2c(C)cccc2)n1)=O

InChI

InChI=1S/C28H28FN3O2/c1-20-8-6-7-11-24(20)17-32(16-22-12-14-25(29)15-13-22)18-27-31-26(19-34-27)28(33)30-21(2)23-9-4-3-5-10-23/h3-15,19,21H,16-18H2,1-2H3,(H,30,33)/t21-/m0/s1

InChI Key

HPHLRTBUNIEMBD-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19835379

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.320

Distribution Coefficient, logD

5.320

Water Solubility, LogSw

-5.28

Polar Surface Area

45.661

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.40

References: we are preparing a list of scientific research reports with V020-9979 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-9979?
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What is the minimum amount of V020-9979 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-9979
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-9979
  • 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 V020-9979 available by request