D278-0534 Screening compound: N1,N1-dimethyl-N4-[2-(methylsulfanyl)-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl]benzene-1,4-diamine

D278-0534 Screening compound: N1,N1-dimethyl-N4-[2-(methylsulfanyl)-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl]benzene-1,4-diamine
D278-0534 Screening compound: N1,N1-dimethyl-N4-[2-(methylsulfanyl)-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl]benzene-1,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound D278-0534
N1,N1-dimethyl-N4-[2-(methylsulfanyl)-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl]benzene-1,4-diamine

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

D278-0534

Molecular Formula

C16H20N4S (C16 H20 N4 S)

Compound Name

N1,N1-dimethyl-N4-[2-(methylsulfanyl)-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl]benzene-1,4-diamine

IUPAC name

N1N1-dimethyl-N4-[2-(methylsulfanyl)-5H6H7H-cyclopenta[d]pyrimidin-4-yl]benzene-14-diamine

SMILES

CN(C)c(cc1)ccc1Nc1c(CCC2)c2nc(SC)n1

InChI

InChI=1S/C16H20N4S/c1-20(2)12-9-7-11(8-10-12)17-15-13-5-4-6-14(13)18-16(19-15)21-3/h7-10H,4-6H2,1-3H3,(H,17,18,19)

InChI Key

HIEHMBKEGLYLBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10044471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.079

Distribution Coefficient, logD

3.986

Water Solubility, LogSw

-4.19

Polar Surface Area

31.676

Acid Dissociation Constant (pKa)

15.17

Base Dissociation Constant (pKb)

6.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

D278-0534 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Akt-Targeted Library (14764 compounds)

Antibacterial Compounds Library (13827 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with D278-0534 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D278-0534?
Check Price and Availability of D278-0534, 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 D278-0534 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D278-0534
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D278-0534
  • 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 D278-0534 available by request