F994-0327 Screening compound: N-(4-{[4,6-dioxo-5,7-bis(propan-2-yl)-2H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidin-2-yl]sulfonyl}phenyl)-3-methylbutanamide

F994-0327 Screening compound: N-(4-{[4,6-dioxo-5,7-bis(propan-2-yl)-2H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidin-2-yl]sulfonyl}phenyl)-3-methylbutanamide
F994-0327 Screening compound: N-(4-{[4,6-dioxo-5,7-bis(propan-2-yl)-2H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidin-2-yl]sulfonyl}phenyl)-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F994-0327
N-(4-{[4,6-dioxo-5,7-bis(propan-2-yl)-2H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidin-2-yl]sulfonyl}phenyl)-3-methylbutanamide

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

F994-0327

Molecular Formula

C22H29N5O5S (C22 H29 N5 O5 S)

Compound Name

N-(4-{[4,6-dioxo-5,7-bis(propan-2-yl)-2H,4H,5H,6H,7H-pyrazolo[3,4-d]pyrimidin-2-yl]sulfonyl}phenyl)-3-methylbutanamide

IUPAC name

N-(4-{[46-dioxo-57-bis(propan-2-yl)-2H4H5H6H7H-pyrazolo[34-d]pyrimidin-2-yl]sulfonyl}phenyl)-3-methylbutanamide

SMILES

CC(C)CC(Nc(cc1)ccc1S(n(cc1C(N2C(C)C)=O)nc1N(C(C)C)C2=O)(=O)=O)=O

InChI

InChI=1S/C22H29N5O5S/c1-13(2)11-19(28)23-16-7-9-17(10-8-16)33(31,32)25-12-18-20(24-25)26(14(3)4)22(30)27(15(5)6)21(18)29/h7-10,12-15H,11H2,1-6H3,(H,23,28)

InChI Key

MAPRBRRJMNTVKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14974032

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.57

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.196

Distribution Coefficient, logD

3.196

Water Solubility, LogSw

-3.63

Polar Surface Area

97.178

Acid Dissociation Constant (pKa)

10.34

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with F994-0327 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F994-0327?
Check Price and Availability of F994-0327, 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 F994-0327 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F994-0327
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F994-0327
  • 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 F994-0327 available by request