C999-1028 Screening compound: 2-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(4-methoxyphenyl)methyl]acetamide

C999-1028 Screening compound: 2-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(4-methoxyphenyl)methyl]acetamide
C999-1028 Screening compound: 2-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(4-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C999-1028
2-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(4-methoxyphenyl)methyl]acetamide

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

C999-1028

Molecular Formula

C25H25FN4O2 (C25 H25 FN4 O2)

Compound Name

2-[3-(4-fluorophenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(4-methoxyphenyl)methyl]acetamide

IUPAC name

2-[3-(4-fluorophenyl)-257-trimethylpyrazolo[15-a]pyrimidin-6-yl]-N-[(4-methoxyphenyl)methyl]acetamide

SMILES

Cc1nn2c(C)c(CC(NCc(cc3)ccc3OC)=O)c(C)nc2c1-c(cc1)ccc1F

InChI

InChI=1S/C25H25FN4O2/c1-15-22(13-23(31)27-14-18-5-11-21(32-4)12-6-18)17(3)30-25(28-15)24(16(2)29-30)19-7-9-20(26)10-8-19/h5-12H,13-14H2,1-4H3,(H,27,31)

InChI Key

CFXVPOWTQULKHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14810084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.664

Distribution Coefficient, logD

3.664

Water Solubility, LogSw

-4.33

Polar Surface Area

52.588

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

3.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

C999-1028 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C999-1028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C999-1028?
Check Price and Availability of C999-1028, 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 C999-1028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C999-1028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C999-1028
  • 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 C999-1028 available by request