V030-5748 Screening compound: CYCLOPENTYL[3-(4-FLUOROPHENYL)-4-(1-PYRROLIDINYLMETHYL)-1-PYRROLIDINYL]METHANONE

V030-5748 Screening compound: CYCLOPENTYL[3-(4-FLUOROPHENYL)-4-(1-PYRROLIDINYLMETHYL)-1-PYRROLIDINYL]METHANONE
V030-5748 Screening compound: CYCLOPENTYL[3-(4-FLUOROPHENYL)-4-(1-PYRROLIDINYLMETHYL)-1-PYRROLIDINYL]METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-5748
CYCLOPENTYL[3-(4-FLUOROPHENYL)-4-(1-PYRROLIDINYLMETHYL)-1-PYRROLIDINYL]METHANONE

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

V030-5748

Molecular Formula

C21H29FN2O (C21 H29 FN2 O)

Compound Name

CYCLOPENTYL[3-(4-FLUOROPHENYL)-4-(1-PYRROLIDINYLMETHYL)-1-PYRROLIDINYL]METHANONE

IUPAC name

n/a

SMILES

O=C(C1CCCC1)N(CC1CN2CCCC2)CC1c(cc1)ccc1F

InChI

InChI=1S/C21H29FN2O/c22-19-9-7-16(8-10-19)20-15-24(21(25)17-5-1-2-6-17)14-18(20)13-23-11-3-4-12-23/h7-10,17-18,20H,1-6,11-15H2

InChI Key

JOEALZBJUWQWBO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

344.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.664

Distribution Coefficient, logD

0.539

Water Solubility, LogSw

-3.88

Polar Surface Area

21.505

Acid Dissociation Constant (pKa)

22.61

Base Dissociation Constant (pKb)

10.53

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

66.70

V030-5748 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V030-5748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-5748?
Check Price and Availability of V030-5748, 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 V030-5748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-5748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-5748
  • 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 V030-5748 available by request