V013-4297 Screening compound: 2-({[(2,4-difluorophenyl)methyl][(4-fluorophenyl)methyl]amino}methyl)-N-(2-methoxyethyl)-1,3-oxazole-4-carboxamide

V013-4297 Screening compound: 2-({[(2,4-difluorophenyl)methyl][(4-fluorophenyl)methyl]amino}methyl)-N-(2-methoxyethyl)-1,3-oxazole-4-carboxamide
V013-4297 Screening compound: 2-({[(2,4-difluorophenyl)methyl][(4-fluorophenyl)methyl]amino}methyl)-N-(2-methoxyethyl)-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-4297
2-({[(2,4-difluorophenyl)methyl][(4-fluorophenyl)methyl]amino}methyl)-N-(2-methoxyethyl)-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

V013-4297

Molecular Formula

C22H22F3N3O3 (C22 H22 F3 N3 O3)

Compound Name

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

IUPAC name

2-({[(24-difluorophenyl)methyl][(4-fluorophenyl)methyl]amino}methyl)-N-(2-methoxyethyl)-13-oxazole-4-carboxamide

SMILES

COCCNC(c1coc(CN(Cc(cc2)ccc2F)Cc(ccc(F)c2)c2F)n1)=O

InChI

InChI=1S/C22H22F3N3O3/c1-30-9-8-26-22(29)20-14-31-21(27-20)13-28(11-15-2-5-17(23)6-3-15)12-16-4-7-18(24)10-19(16)25/h2-7,10,14H,8-9,11-13H2,1H3,(H,26,29)

InChI Key

SBXNYUZJUKYSPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19978497

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

433.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.159

Distribution Coefficient, logD

3.159

Water Solubility, LogSw

-3.24

Polar Surface Area

54.953

Acid Dissociation Constant (pKa)

13.94

Base Dissociation Constant (pKb)

1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

V013-4297 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V013-4297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-4297?
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What is the minimum amount of V013-4297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-4297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-4297
  • 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 V013-4297 available by request