V003-8746 Screening compound: 2-{[(3-chlorophenyl)methyl][(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]amino}-1-phenylethan-1-ol

V003-8746 Screening compound: 2-{[(3-chlorophenyl)methyl][(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]amino}-1-phenylethan-1-ol
V003-8746 Screening compound: 2-{[(3-chlorophenyl)methyl][(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]amino}-1-phenylethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-8746
2-{[(3-chlorophenyl)methyl][(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]amino}-1-phenylethan-1-ol

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

V003-8746

Molecular Formula

C25H25ClN2O2 (C25 H25 ClN2 O2)

Compound Name

2-{[(3-chlorophenyl)methyl][(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]amino}-1-phenylethan-1-ol

IUPAC name

2-{[(3-chlorophenyl)methyl][(3-phenyl-45-dihydro-12-oxazol-5-yl)methyl]amino}-1-phenylethan-1-ol

SMILES

OC(CN(CC(C1)ON=C1c1ccccc1)Cc1cccc(Cl)c1)c1ccccc1

InChI

InChI=1S/C25H25ClN2O2/c26-22-13-7-8-19(14-22)16-28(18-25(29)21-11-5-2-6-12-21)17-23-15-24(27-30-23)20-9-3-1-4-10-20/h1-14,23,25,29H,15-18H2

InChI Key

XOZTZVWOEUGXCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19869173

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

420.94

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.068

Distribution Coefficient, logD

5.064

Water Solubility, LogSw

-5.24

Polar Surface Area

42.667

Acid Dissociation Constant (pKa)

14.28

Base Dissociation Constant (pKb)

5.35

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

24.00

V003-8746 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V003-8746 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-8746?
Check Price and Availability of V003-8746, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V003-8746 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-8746
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-8746
  • 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 V003-8746 available by request