V016-8204 Screening compound: 1-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-4-(4-chloro-3-nitrobenzenesulfonyl)piperazine

V016-8204 Screening compound: 1-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-4-(4-chloro-3-nitrobenzenesulfonyl)piperazine
V016-8204 Screening compound: 1-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-4-(4-chloro-3-nitrobenzenesulfonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-8204
1-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-4-(4-chloro-3-nitrobenzenesulfonyl)piperazine

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

V016-8204

Molecular Formula

C26H28ClN7O4S (C26 H28 ClN7 O4 S)

Compound Name

1-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-4-(4-chloro-3-nitrobenzenesulfonyl)piperazine

IUPAC name

1-{6-butyl-3-methyl-1-phenyl-1H-pyrazolo[34-d]pyrimidin-4-yl}-4-(4-chloro-3-nitrobenzenesulfonyl)piperazine

SMILES

CCCCc1nc(n(-c2ccccc2)nc2C)c2c(N(CC2)CCN2S(c(cc2)cc([N+]([O-])=O)c2Cl)(=O)=O)n1

InChI

InChI=1S/C26H28ClN7O4S/c1-3-4-10-23-28-25(24-18(2)30-33(26(24)29-23)19-8-6-5-7-9-19)31-13-15-32(16-14-31)39(37,38)20-11-12-21(27)22(17-20)34(35)36/h5-9,11-12,17H,3-4,10,13-16H2,1-2H3

InChI Key

WBJRLKIWNRJOIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19856920

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

570.07

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

5.643

Distribution Coefficient, logD

5.097

Water Solubility, LogSw

-5.93

Polar Surface Area

102.565

Acid Dissociation Constant (pKa)

21.40

Base Dissociation Constant (pKb)

7.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

V016-8204 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V016-8204 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-8204?
Check Price and Availability of V016-8204, 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 V016-8204 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-8204
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-8204
  • 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 V016-8204 available by request