V008-1097 Screening compound: 4-benzyl-1-{[1-(4-methoxybenzoyl)-4-(2-methoxyphenyl)pyrrolidin-3-yl]methyl}piperidine

V008-1097 Screening compound: 4-benzyl-1-{[1-(4-methoxybenzoyl)-4-(2-methoxyphenyl)pyrrolidin-3-yl]methyl}piperidine
V008-1097 Screening compound: 4-benzyl-1-{[1-(4-methoxybenzoyl)-4-(2-methoxyphenyl)pyrrolidin-3-yl]methyl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1097
4-benzyl-1-{[1-(4-methoxybenzoyl)-4-(2-methoxyphenyl)pyrrolidin-3-yl]methyl}piperidine

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

V008-1097

Molecular Formula

C32H38N2O3 (C32 H38 N2 O3)

Compound Name

4-benzyl-1-{[1-(4-methoxybenzoyl)-4-(2-methoxyphenyl)pyrrolidin-3-yl]methyl}piperidine

IUPAC name

4-benzyl-1-{[1-(4-methoxybenzoyl)-4-(2-methoxyphenyl)pyrrolidin-3-yl]methyl}piperidine

SMILES

COc(cc1)ccc1C(N(CC1CN2CCC(Cc3ccccc3)CC2)CC1c(cccc1)c1OC)=O

InChI

InChI=1S/C32H38N2O3/c1-36-28-14-12-26(13-15-28)32(35)34-22-27(30(23-34)29-10-6-7-11-31(29)37-2)21-33-18-16-25(17-19-33)20-24-8-4-3-5-9-24/h3-15,25,27,30H,16-23H2,1-2H3

InChI Key

KEUJFYNLYGCRQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19922222

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

498.67

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.992

Distribution Coefficient, logD

3.885

Water Solubility, LogSw

-5.52

Polar Surface Area

35.483

Acid Dissociation Constant (pKa)

23.81

Base Dissociation Constant (pKb)

9.50

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.63

V008-1097 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with V008-1097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1097?
Check Price and Availability of V008-1097, 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 V008-1097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1097
  • 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 V008-1097 available by request