V028-7787 Screening compound: 4-fluoro-N-(3-{[1-(3-nitrobenzoyl)pyrrolidin-2-yl]formamido}propyl)benzamide

V028-7787 Screening compound: 4-fluoro-N-(3-{[1-(3-nitrobenzoyl)pyrrolidin-2-yl]formamido}propyl)benzamide
V028-7787 Screening compound: 4-fluoro-N-(3-{[1-(3-nitrobenzoyl)pyrrolidin-2-yl]formamido}propyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-7787
4-fluoro-N-(3-{[1-(3-nitrobenzoyl)pyrrolidin-2-yl]formamido}propyl)benzamide

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

V028-7787

Molecular Formula

C22H23FN4O5 (C22 H23 FN4 O5)

Compound Name

4-fluoro-N-(3-{[1-(3-nitrobenzoyl)pyrrolidin-2-yl]formamido}propyl)benzamide

IUPAC name

4-fluoro-N-(3-{[(2S)-1-(3-nitrobenzoyl)pyrrolidin-2-yl]formamido}propyl)benzamide

SMILES

[O-][N+](c1cccc(C(N(CCC2)C2C(NCCCNC(c(cc2)ccc2F)=O)=O)=O)c1)=O

InChI

InChI=1S/C22H23FN4O5/c23-17-9-7-15(8-10-17)20(28)24-11-3-12-25-21(29)19-6-2-13-26(19)22(30)16-4-1-5-18(14-16)27(31)32/h1,4-5,7-10,14,19H,2-3,6,11-13H2,(H,24,28)(H,25,29)/t19-/m0/s1

InChI Key

FJQAMQZHHUMHDZ-IBGZPJMESA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

442.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.519

Distribution Coefficient, logD

1.519

Water Solubility, LogSw

-2.20

Polar Surface Area

99.109

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

-0.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

V028-7787 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V028-7787 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-7787?
Check Price and Availability of V028-7787, 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 V028-7787 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-7787
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-7787
  • 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 V028-7787 available by request