V018-8169 Screening compound: 1-{2-[3-(2-chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-4-carboxamide

V018-8169 Screening compound: 1-{2-[3-(2-chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-4-carboxamide
V018-8169 Screening compound: 1-{2-[3-(2-chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8169
1-{2-[3-(2-chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-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

V018-8169

Molecular Formula

C25H29ClN4O3 (C25 H29 ClN4 O3)

Compound Name

1-{2-[3-(2-chlorophenyl)-5-(4-ethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-4-carboxamide

IUPAC name

1-{2-[3-(2-chlorophenyl)-5-(4-ethoxyphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}piperidine-4-carboxamide

SMILES

CCOc1ccc(C(C2)N(C(CN(CC3)CCC3C(N)=O)=O)N=C2c(cccc2)c2Cl)cc1

InChI

InChI=1S/C25H29ClN4O3/c1-2-33-19-9-7-17(8-10-19)23-15-22(20-5-3-4-6-21(20)26)28-30(23)24(31)16-29-13-11-18(12-14-29)25(27)32/h3-10,18,23H,2,11-16H2,1H3,(H2,27,32)/t23-/m1/s1

InChI Key

SWJIGHOIZREQPN-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD19886096

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

468.98

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.222

Distribution Coefficient, logD

2.509

Water Solubility, LogSw

-3.73

Polar Surface Area

71.774

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

V018-8169 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V018-8169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8169?
Check Price and Availability of V018-8169, 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 V018-8169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8169
  • 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 V018-8169 available by request