D430-1275 Screening compound: 2-fluoro-N-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)benzene-1-sulfonamide

D430-1275 Screening compound: 2-fluoro-N-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)benzene-1-sulfonamide
D430-1275 Screening compound: 2-fluoro-N-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D430-1275
2-fluoro-N-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)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

D430-1275

Molecular Formula

C22H24FN5O2S (C22 H24 FN5 O2 S)

Compound Name

2-fluoro-N-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)benzene-1-sulfonamide

IUPAC name

2-fluoro-N-(4-{[2-methyl-6-(piperidin-1-yl)pyrimidin-4-yl]amino}phenyl)benzene-1-sulfonamide

SMILES

Cc1nc(N2CCCCC2)cc(Nc(cc2)ccc2NS(c(cccc2)c2F)(=O)=O)n1

InChI

InChI=1S/C22H24FN5O2S/c1-16-24-21(15-22(25-16)28-13-5-2-6-14-28)26-17-9-11-18(12-10-17)27-31(29,30)20-8-4-3-7-19(20)23/h3-4,7-12,15,27H,2,5-6,13-14H2,1H3,(H,24,25,26)

InChI Key

DCKVXIQBVVZCMY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.857

Distribution Coefficient, logD

4.299

Water Solubility, LogSw

-4.56

Polar Surface Area

71.468

Acid Dissociation Constant (pKa)

8.91

Base Dissociation Constant (pKb)

7.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

D430-1275 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D430-1275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D430-1275?
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What is the minimum amount of D430-1275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D430-1275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D430-1275
  • 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 D430-1275 available by request