D575-0092 Screening compound: N-ethyl-4-[4-(5-methoxy-2,4-dimethylbenzenesulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine

D575-0092 Screening compound: N-ethyl-4-[4-(5-methoxy-2,4-dimethylbenzenesulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
D575-0092 Screening compound: N-ethyl-4-[4-(5-methoxy-2,4-dimethylbenzenesulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D575-0092
N-ethyl-4-[4-(5-methoxy-2,4-dimethylbenzenesulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine

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

D575-0092

Molecular Formula

C20H29N5O3S (C20 H29 N5 O3 S)

Compound Name

N-ethyl-4-[4-(5-methoxy-2,4-dimethylbenzenesulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine

IUPAC name

N-ethyl-4-[4-(5-methoxy-24-dimethylbenzenesulfonyl)piperazin-1-yl]-6-methylpyrimidin-2-amine

SMILES

CCNc1nc(C)cc(N(CC2)CCN2S(c2c(C)cc(C)c(OC)c2)(=O)=O)n1

InChI

InChI=1S/C20H29N5O3S/c1-6-21-20-22-16(4)12-19(23-20)24-7-9-25(10-8-24)29(26,27)18-13-17(28-5)14(2)11-15(18)3/h11-13H,6-10H2,1-5H3,(H,21,22,23)

InChI Key

KXORTXLOXYDRKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27593248

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.956

Distribution Coefficient, logD

3.851

Water Solubility, LogSw

-3.97

Polar Surface Area

71.947

Acid Dissociation Constant (pKa)

18.81

Base Dissociation Constant (pKb)

6.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

D575-0092 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D575-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D575-0092?
Check Price and Availability of D575-0092, 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 D575-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D575-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D575-0092
  • 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 D575-0092 available by request