V025-8797 Screening compound: N-benzyl-1-(3-methylphenyl)-5-oxo-N-(2-phenylethyl)pyrrolidine-3-carboxamide

V025-8797 Screening compound: N-benzyl-1-(3-methylphenyl)-5-oxo-N-(2-phenylethyl)pyrrolidine-3-carboxamide
V025-8797 Screening compound: N-benzyl-1-(3-methylphenyl)-5-oxo-N-(2-phenylethyl)pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-8797
N-benzyl-1-(3-methylphenyl)-5-oxo-N-(2-phenylethyl)pyrrolidine-3-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

V025-8797

Molecular Formula

C27H28N2O2 (C27 H28 N2 O2)

Compound Name

N-benzyl-1-(3-methylphenyl)-5-oxo-N-(2-phenylethyl)pyrrolidine-3-carboxamide

IUPAC name

N-benzyl-1-(3-methylphenyl)-5-oxo-N-(2-phenylethyl)pyrrolidine-3-carboxamide

SMILES

Cc1cccc(N(CC(C2)C(N(CCc3ccccc3)Cc3ccccc3)=O)C2=O)c1

InChI

InChI=1S/C27H28N2O2/c1-21-9-8-14-25(17-21)29-20-24(18-26(29)30)27(31)28(19-23-12-6-3-7-13-23)16-15-22-10-4-2-5-11-22/h2-14,17,24H,15-16,18-20H2,1H3/t24-/m1/s1

InChI Key

LXFIBJXECMYODA-XMMPIXPASA-N

MDL Number (MFCD)

MFCD19971740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.516

Distribution Coefficient, logD

4.516

Water Solubility, LogSw

-4.42

Polar Surface Area

32.906

Acid Dissociation Constant (pKa)

13.27

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.90

V025-8797 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with V025-8797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-8797?
Check Price and Availability of V025-8797, 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 V025-8797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-8797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-8797
  • 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 V025-8797 available by request