1488-0648 Screening compound: 3,4,5-trimethoxy-N-{4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}benzamide

1488-0648 Screening compound: 3,4,5-trimethoxy-N-{4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}benzamide
1488-0648 Screening compound: 3,4,5-trimethoxy-N-{4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1488-0648
3,4,5-trimethoxy-N-{4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}benzamide

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

1488-0648

Molecular Formula

C21H22N4O7S (C21 H22 N4 O7 S)

Compound Name

3,4,5-trimethoxy-N-{4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}benzamide

IUPAC name

345-trimethoxy-N-{4-[(3-methoxypyrazin-2-yl)sulfamoyl]phenyl}benzamide

SMILES

COc1cc(C(Nc(cc2)ccc2S(Nc2nccnc2OC)(=O)=O)=O)cc(OC)c1OC

InChI

InChI=1S/C21H22N4O7S/c1-29-16-11-13(12-17(30-2)18(16)31-3)20(26)24-14-5-7-15(8-6-14)33(27,28)25-19-21(32-4)23-10-9-22-19/h5-12H,1-4H3,(H,22,25)(H,24,26)

InChI Key

GUACKUAGPJISEU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00563763

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.49

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.578

Distribution Coefficient, logD

1.078

Water Solubility, LogSw

-3.32

Polar Surface Area

113.994

Acid Dissociation Constant (pKa)

5.91

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

1488-0648 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1488-0648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1488-0648?
Check Price and Availability of 1488-0648, 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 1488-0648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1488-0648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1488-0648
  • 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 1488-0648 available by request