V020-5212 Screening compound: N-(2-methoxyethyl)-2-methyl-N-{[4-(2-methylphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}propanamide

V020-5212 Screening compound: N-(2-methoxyethyl)-2-methyl-N-{[4-(2-methylphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}propanamide
V020-5212 Screening compound: N-(2-methoxyethyl)-2-methyl-N-{[4-(2-methylphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-5212
N-(2-methoxyethyl)-2-methyl-N-{[4-(2-methylphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}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

V020-5212

Molecular Formula

C27H35F3N2O2 (C27 H35 F3 N2 O2)

Compound Name

N-(2-methoxyethyl)-2-methyl-N-{[4-(2-methylphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}propanamide

IUPAC name

N-(2-methoxyethyl)-2-methyl-N-{[4-(2-methylphenyl)-1-{[3-(trifluoromethyl)phenyl]methyl}pyrrolidin-3-yl]methyl}propanamide

SMILES

CC(C)C(N(CCOC)CC(CN(Cc1cccc(C(F)(F)F)c1)C1)C1c1c(C)cccc1)=O

InChI

InChI=1S/C27H35F3N2O2/c1-19(2)26(33)32(12-13-34-4)17-22-16-31(18-25(22)24-11-6-5-8-20(24)3)15-21-9-7-10-23(14-21)27(28,29)30/h5-11,14,19,22,25H,12-13,15-18H2,1-4H3

InChI Key

XPEYLXKWZFOJEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19893333

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

476.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.296

Distribution Coefficient, logD

4.219

Water Solubility, LogSw

-5.34

Polar Surface Area

28.736

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

8.44

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

51.90

V020-5212 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 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 V020-5212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-5212?
Check Price and Availability of V020-5212, 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 V020-5212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-5212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-5212
  • 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 V020-5212 available by request