V003-1504 Screening compound: 2-({[(2,4-difluorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide

V003-1504 Screening compound: 2-({[(2,4-difluorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide
V003-1504 Screening compound: 2-({[(2,4-difluorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-1504
2-({[(2,4-difluorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}methyl)-N-[(pyridin-2-yl)methyl]-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

V003-1504

Molecular Formula

C28H25F2N5O2 (C28 H25 F2 N5 O2)

Compound Name

2-({[(2,4-difluorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}methyl)-N-[(pyridin-2-yl)methyl]-1,3-oxazole-4-carboxamide

IUPAC name

2-({[(24-difluorophenyl)methyl][2-(1H-indol-3-yl)ethyl]amino}methyl)-N-[(pyridin-2-yl)methyl]-13-oxazole-4-carboxamide

SMILES

O=C(c1coc(CN(CCc2c[nH]c3c2cccc3)Cc(ccc(F)c2)c2F)n1)NCc1ncccc1

InChI

InChI=1S/C28H25F2N5O2/c29-21-9-8-20(24(30)13-21)16-35(12-10-19-14-32-25-7-2-1-6-23(19)25)17-27-34-26(18-37-27)28(36)33-15-22-5-3-4-11-31-22/h1-9,11,13-14,18,32H,10,12,15-17H2,(H,33,36)

InChI Key

OTMFLMXLMFPVBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19827076

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

501.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.098

Distribution Coefficient, logD

4.098

Water Solubility, LogSw

-4.26

Polar Surface Area

65.890

Acid Dissociation Constant (pKa)

12.29

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

V003-1504 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with V003-1504 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-1504?
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What is the minimum amount of V003-1504 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-1504
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-1504
  • 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 V003-1504 available by request