V025-3416 Screening compound: ethyl 1-{4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}piperidine-4-carboxylate

V025-3416 Screening compound: ethyl 1-{4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}piperidine-4-carboxylate
V025-3416 Screening compound: ethyl 1-{4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-3416
ethyl 1-{4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}piperidine-4-carboxylate

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

V025-3416

Molecular Formula

C23H26N2O3S (C23 H26 N2 O3 S)

Compound Name

ethyl 1-{4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{4-[(4-methylphenyl)methyl]-4H-thieno[32-b]pyrrole-5-carbonyl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1cc(scc2)c2n1Cc1ccc(C)cc1)=O)=O

InChI

InChI=1S/C23H26N2O3S/c1-3-28-23(27)18-8-11-24(12-9-18)22(26)20-14-21-19(10-13-29-21)25(20)15-17-6-4-16(2)5-7-17/h4-7,10,13-14,18H,3,8-9,11-12,15H2,1-2H3

InChI Key

UWGYPBCAQOGCOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19895192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.548

Distribution Coefficient, logD

4.548

Water Solubility, LogSw

-4.26

Polar Surface Area

39.113

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

V025-3416 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V025-3416 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-3416?
Check Price and Availability of V025-3416, 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 V025-3416 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-3416
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-3416
  • 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 V025-3416 available by request