D430-1294 Screening compound: N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide

D430-1294 Screening compound: N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide
D430-1294 Screening compound: N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D430-1294
N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-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

D430-1294

Molecular Formula

C21H22N6O5S (C21 H22 N6 O5 S)

Compound Name

N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide

IUPAC name

N-(4-{[2-methyl-6-(morpholin-4-yl)pyrimidin-4-yl]amino}phenyl)-4-nitrobenzene-1-sulfonamide

SMILES

Cc1nc(N2CCOCC2)cc(Nc(cc2)ccc2NS(c(cc2)ccc2[N+]([O-])=O)(=O)=O)n1

InChI

InChI=1S/C21H22N6O5S/c1-15-22-20(14-21(23-15)26-10-12-32-13-11-26)24-16-2-4-17(5-3-16)25-33(30,31)19-8-6-18(7-9-19)27(28)29/h2-9,14,25H,10-13H2,1H3,(H,22,23,24)

InChI Key

VBQJJFSPANWYPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.51

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.756

Distribution Coefficient, logD

3.204

Water Solubility, LogSw

-3.96

Polar Surface Area

112.758

Acid Dissociation Constant (pKa)

7.80

Base Dissociation Constant (pKb)

7.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with D430-1294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D430-1294?
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What is the minimum amount of D430-1294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D430-1294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D430-1294
  • 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 D430-1294 available by request