V026-7758 Screening compound: 1-{[5-(2-chlorophenyl)-3-isoxazolyl]carbonyl}-N~2~-(4-fluorobenzyl)-2-pyrrolidinecarboxamide

V026-7758 Screening compound: 1-{[5-(2-chlorophenyl)-3-isoxazolyl]carbonyl}-N~2~-(4-fluorobenzyl)-2-pyrrolidinecarboxamide
V026-7758 Screening compound: 1-{[5-(2-chlorophenyl)-3-isoxazolyl]carbonyl}-N~2~-(4-fluorobenzyl)-2-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-7758
1-{[5-(2-chlorophenyl)-3-isoxazolyl]carbonyl}-N~2~-(4-fluorobenzyl)-2-pyrrolidinecarboxamide

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

V026-7758

Molecular Formula

C22H19ClFN3O3 (C22 H19 ClFN3 O3)

Compound Name

1-{[5-(2-chlorophenyl)-3-isoxazolyl]carbonyl}-N~2~-(4-fluorobenzyl)-2-pyrrolidinecarboxamide

IUPAC name

1-[5-(2-chlorophenyl)-12-oxazole-3-carbonyl]-N-[(4-fluorophenyl)methyl]pyrrolidine-2-carboxamide

SMILES

O=C(C(CCC1)N1C(c1noc(-c(cccc2)c2Cl)c1)=O)NCc(cc1)ccc1F

InChI

InChI=1S/C22H19ClFN3O3/c23-17-5-2-1-4-16(17)20-12-18(26-30-20)22(29)27-11-3-6-19(27)21(28)25-13-14-7-9-15(24)10-8-14/h1-2,4-5,7-10,12,19H,3,6,11,13H2,(H,25,28)/t19-/m0/s1

InChI Key

KVYPOICWQVAGMT-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19813162

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

427.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.397

Distribution Coefficient, logD

3.397

Water Solubility, LogSw

-3.91

Polar Surface Area

62.895

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

-2.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.73

V026-7758 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V026-7758 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-7758?
Check Price and Availability of V026-7758, 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 V026-7758 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-7758
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-7758
  • 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 V026-7758 available by request