V008-1099 Screening compound: N-{[4-(4-fluorophenyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl}-2-methyl-N-(2-methylpropyl)propanamide

V008-1099 Screening compound: N-{[4-(4-fluorophenyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl}-2-methyl-N-(2-methylpropyl)propanamide
V008-1099 Screening compound: N-{[4-(4-fluorophenyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl}-2-methyl-N-(2-methylpropyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-1099
N-{[4-(4-fluorophenyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl}-2-methyl-N-(2-methylpropyl)propanamide

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

V008-1099

Molecular Formula

C27H37FN2O (C27 H37 FN2 O)

Compound Name

N-{[4-(4-fluorophenyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl}-2-methyl-N-(2-methylpropyl)propanamide

IUPAC name

N-{[4-(4-fluorophenyl)-1-[(3-methylphenyl)methyl]pyrrolidin-3-yl]methyl}-2-methyl-N-(2-methylpropyl)propanamide

SMILES

CC(C)CN(CC(CN(Cc1cc(C)ccc1)C1)C1c(cc1)ccc1F)C(C(C)C)=O

InChI

InChI=1S/C27H37FN2O/c1-19(2)14-30(27(31)20(3)4)17-24-16-29(15-22-8-6-7-21(5)13-22)18-26(24)23-9-11-25(28)12-10-23/h6-13,19-20,24,26H,14-18H2,1-5H3

InChI Key

FPIMFSDWJNQFPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19932114

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

424.6

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.104

Distribution Coefficient, logD

3.642

Water Solubility, LogSw

-5.44

Polar Surface Area

20.415

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

9.86

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

51.85

V008-1099 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V008-1099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-1099?
Check Price and Availability of V008-1099, 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 V008-1099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-1099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-1099
  • 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 V008-1099 available by request