3332-3762 Screening compound: 4-({3-formyl-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}amino)benzene-1-sulfonamide

3332-3762 Screening compound: 4-({3-formyl-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}amino)benzene-1-sulfonamide
3332-3762 Screening compound: 4-({3-formyl-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}amino)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3332-3762
4-({3-formyl-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}amino)benzene-1-sulfonamide

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

3332-3762

Molecular Formula

C16H14N4O4S (C16 H14 N4 O4 S)

Compound Name

4-({3-formyl-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}amino)benzene-1-sulfonamide

IUPAC name

4-({3-formyl-9-methyl-4-oxo-4H-pyrido[12-a]pyrimidin-2-yl}amino)benzene-1-sulfonamide

SMILES

CC(C1=NC(Nc(cc2)ccc2S(N)(=O)=O)=C2C=O)=CC=CN1C2=O

InChI

InChI=1S/C16H14N4O4S/c1-10-3-2-8-20-15(10)19-14(13(9-21)16(20)22)18-11-4-6-12(7-5-11)25(17,23)24/h2-9,18H,1H3,(H2,17,23,24)

InChI Key

FVRAQHCZAUXGEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01912535

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.248

Distribution Coefficient, logD

-1.835

Water Solubility, LogSw

-1.99

Polar Surface Area

97.442

Acid Dissociation Constant (pKa)

5.32

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

3332-3762 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 3332-3762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3332-3762?
Check Price and Availability of 3332-3762, 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 3332-3762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3332-3762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3332-3762
  • 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 3332-3762 available by request