D306-0512 Screening compound: methyl 4-methyl-2-[2-({2-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamido]-1,3-thiazole-5-carboxylate

D306-0512 Screening compound: methyl 4-methyl-2-[2-({2-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamido]-1,3-thiazole-5-carboxylate
D306-0512 Screening compound: methyl 4-methyl-2-[2-({2-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamido]-1,3-thiazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D306-0512
methyl 4-methyl-2-[2-({2-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamido]-1,3-thiazole-5-carboxylate

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

D306-0512

Molecular Formula

C16H18N4O3S2 (C16 H18 N4 O3 S2)

Compound Name

methyl 4-methyl-2-[2-({2-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamido]-1,3-thiazole-5-carboxylate

IUPAC name

methyl 4-methyl-2-[2-({2-methyl-5H6H7H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamido]-13-thiazole-5-carboxylate

SMILES

Cc1c(C(OC)=O)sc(NC(CSc2nc(C)nc3c2CCC3)=O)n1

InChI

InChI=1S/C16H18N4O3S2/c1-8-13(15(22)23-3)25-16(17-8)20-12(21)7-24-14-10-5-4-6-11(10)18-9(2)19-14/h4-7H2,1-3H3,(H,17,20,21)

InChI Key

OJWVIDRZANHVEI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10480200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.859

Distribution Coefficient, logD

2.804

Water Solubility, LogSw

-3.21

Polar Surface Area

75.016

Acid Dissociation Constant (pKa)

8.34

Base Dissociation Constant (pKb)

5.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

D306-0512 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D306-0512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D306-0512?
Check Price and Availability of D306-0512, 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 D306-0512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D306-0512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D306-0512
  • 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 D306-0512 available by request