V029-5240 Screening compound: ETHYL 4-[2-TERT-BUTYL-5-(4-METHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-7-CARBONYL]PIPERAZINE-1-CARBOXYLATE

V029-5240 Screening compound: ETHYL 4-[2-TERT-BUTYL-5-(4-METHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-7-CARBONYL]PIPERAZINE-1-CARBOXYLATE
V029-5240 Screening compound: ETHYL 4-[2-TERT-BUTYL-5-(4-METHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-7-CARBONYL]PIPERAZINE-1-CARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-5240
ETHYL 4-[2-TERT-BUTYL-5-(4-METHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-7-CARBONYL]PIPERAZINE-1-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

V029-5240

Molecular Formula

C25H31N5O4 (C25 H31 N5 O4)

Compound Name

ETHYL 4-[2-TERT-BUTYL-5-(4-METHOXYPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE-7-CARBONYL]PIPERAZINE-1-CARBOXYLATE

IUPAC name

ethyl 4-[2-tert-butyl-5-(4-methoxyphenyl)pyrazolo[15-a]pyrimidine-7-carbonyl]piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(c1cc(-c(cc2)ccc2OC)nc2cc(C(C)(C)C)nn12)=O)=O

InChI

InChI=1S/C25H31N5O4/c1-6-34-24(32)29-13-11-28(12-14-29)23(31)20-15-19(17-7-9-18(33-5)10-8-17)26-22-16-21(25(2,3)4)27-30(20)22/h7-10,15-16H,6,11-14H2,1-5H3

InChI Key

QGFMXGORRIGDBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19941409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.460

Distribution Coefficient, logD

4.458

Water Solubility, LogSw

-4.33

Polar Surface Area

65.370

Acid Dissociation Constant (pKa)

28.63

Base Dissociation Constant (pKb)

5.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.00

V029-5240 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 V029-5240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-5240?
Check Price and Availability of V029-5240, 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 V029-5240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-5240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-5240
  • 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 V029-5240 available by request