V002-7279 Screening compound: ethyl 1-[2-(4-chlorophenyl)-7-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]piperidine-4-carboxylate

V002-7279 Screening compound: ethyl 1-[2-(4-chlorophenyl)-7-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]piperidine-4-carboxylate
V002-7279 Screening compound: ethyl 1-[2-(4-chlorophenyl)-7-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-7279
ethyl 1-[2-(4-chlorophenyl)-7-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-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

V002-7279

Molecular Formula

C28H27ClN4O4 (C28 H27 ClN4 O4)

Compound Name

ethyl 1-[2-(4-chlorophenyl)-7-(2-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[2-(4-chlorophenyl)-7-(2-methoxyphenyl)pyrazolo[15-a]pyrimidine-5-carbonyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1nc2cc(-c(cc3)ccc3Cl)nn2c(-c(cccc2)c2OC)c1)=O)=O

InChI

InChI=1S/C28H27ClN4O4/c1-3-37-28(35)19-12-14-32(15-13-19)27(34)23-16-24(21-6-4-5-7-25(21)36-2)33-26(30-23)17-22(31-33)18-8-10-20(29)11-9-18/h4-11,16-17,19H,3,12-15H2,1-2H3

InChI Key

HBOFCLAMUKDIJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19941262

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

519

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.386

Distribution Coefficient, logD

5.386

Water Solubility, LogSw

-5.92

Polar Surface Area

63.158

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

V002-7279 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 V002-7279 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-7279?
Check Price and Availability of V002-7279, 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 V002-7279 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-7279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-7279
  • 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 V002-7279 available by request