V009-5008 Screening compound: N-({1-[(4,5-dimethylfuran-2-yl)methyl]-4-(2-methylphenyl)pyrrolidin-3-yl}methyl)-N-(propan-2-yl)benzamide

V009-5008 Screening compound: N-({1-[(4,5-dimethylfuran-2-yl)methyl]-4-(2-methylphenyl)pyrrolidin-3-yl}methyl)-N-(propan-2-yl)benzamide
V009-5008 Screening compound: N-({1-[(4,5-dimethylfuran-2-yl)methyl]-4-(2-methylphenyl)pyrrolidin-3-yl}methyl)-N-(propan-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-5008
N-({1-[(4,5-dimethylfuran-2-yl)methyl]-4-(2-methylphenyl)pyrrolidin-3-yl}methyl)-N-(propan-2-yl)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

V009-5008

Molecular Formula

C29H36N2O2 (C29 H36 N2 O2)

Compound Name

N-({1-[(4,5-dimethylfuran-2-yl)methyl]-4-(2-methylphenyl)pyrrolidin-3-yl}methyl)-N-(propan-2-yl)benzamide

IUPAC name

N-({1-[(45-dimethylfuran-2-yl)methyl]-4-(2-methylphenyl)pyrrolidin-3-yl}methyl)-N-(propan-2-yl)benzamide

SMILES

CC(C)N(CC(CN(Cc1cc(C)c(C)o1)C1)C1c1c(C)cccc1)C(c1ccccc1)=O

InChI

InChI=1S/C29H36N2O2/c1-20(2)31(29(32)24-12-7-6-8-13-24)17-25-16-30(18-26-15-22(4)23(5)33-26)19-28(25)27-14-10-9-11-21(27)3/h6-15,20,25,28H,16-19H2,1-5H3

InChI Key

TXZOYSCXCOPWJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19922304

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

444.62

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

5.863

Distribution Coefficient, logD

2.315

Water Solubility, LogSw

-5.42

Polar Surface Area

27.383

Acid Dissociation Constant (pKa)

23.12

Base Dissociation Constant (pKb)

10.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

41.40

V009-5008 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V009-5008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-5008?
Check Price and Availability of V009-5008, 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 V009-5008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-5008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-5008
  • 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 V009-5008 available by request