V022-3542 Screening compound: N-(4-chlorophenyl)-2-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carboxamide

V022-3542 Screening compound: N-(4-chlorophenyl)-2-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carboxamide
V022-3542 Screening compound: N-(4-chlorophenyl)-2-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-3542
N-(4-chlorophenyl)-2-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carboxamide

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

V022-3542

Molecular Formula

C25H29ClN4O5 (C25 H29 ClN4 O5)

Compound Name

N-(4-chlorophenyl)-2-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carboxamide

IUPAC name

N-(4-chlorophenyl)-2-({4-[(234-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)-13-oxazole-4-carboxamide

SMILES

COc(ccc(CN1CCN(Cc2nc(C(Nc(cc3)ccc3Cl)=O)co2)CC1)c1OC)c1OC

InChI

InChI=1S/C25H29ClN4O5/c1-32-21-9-4-17(23(33-2)24(21)34-3)14-29-10-12-30(13-11-29)15-22-28-20(16-35-22)25(31)27-19-7-5-18(26)6-8-19/h4-9,16H,10-15H2,1-3H3,(H,27,31)

InChI Key

CQOKMQXMMFLHFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19909899

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

500.98

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.217

Distribution Coefficient, logD

1.975

Water Solubility, LogSw

-3.62

Polar Surface Area

72.073

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

8.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

V022-3542 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V022-3542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-3542?
Check Price and Availability of V022-3542, 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 V022-3542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-3542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-3542
  • 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 V022-3542 available by request