V029-2810 Screening compound: 2-(benzyloxy)-1-[4-(2-{4-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetyl)piperazin-1-yl]ethan-1-one

V029-2810 Screening compound: 2-(benzyloxy)-1-[4-(2-{4-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetyl)piperazin-1-yl]ethan-1-one
V029-2810 Screening compound: 2-(benzyloxy)-1-[4-(2-{4-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetyl)piperazin-1-yl]ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-2810
2-(benzyloxy)-1-[4-(2-{4-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetyl)piperazin-1-yl]ethan-1-one

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

V029-2810

Molecular Formula

C28H31N3O3S (C28 H31 N3 O3 S)

Compound Name

2-(benzyloxy)-1-[4-(2-{4-phenyl-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}acetyl)piperazin-1-yl]ethan-1-one

IUPAC name

2-(benzyloxy)-1-[4-(2-{4-phenyl-4H5H6H7H-thieno[32-c]pyridin-5-yl}acetyl)piperazin-1-yl]ethan-1-one

SMILES

O=C(CN(CCc1c2ccs1)C2c1ccccc1)N(CC1)CCN1C(COCc1ccccc1)=O

InChI

InChI=1S/C28H31N3O3S/c32-26(19-31-13-11-25-24(12-18-35-25)28(31)23-9-5-2-6-10-23)29-14-16-30(17-15-29)27(33)21-34-20-22-7-3-1-4-8-22/h1-10,12,18,28H,11,13-17,19-21H2/t28-/m1/s1

InChI Key

XPBDNPYSRFVPJU-MUUNZHRXSA-N

MDL Number (MFCD)

MFCD19935571

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

489.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.298

Distribution Coefficient, logD

3.290

Water Solubility, LogSw

-3.34

Polar Surface Area

44.885

Acid Dissociation Constant (pKa)

20.42

Base Dissociation Constant (pKb)

5.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

V029-2810 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V029-2810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-2810?
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What is the minimum amount of V029-2810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-2810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-2810
  • 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 V029-2810 available by request