3909-9403 Screening compound: 1-[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]-4-(2-fluorophenyl)piperazine

3909-9403 Screening compound: 1-[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]-4-(2-fluorophenyl)piperazine
3909-9403 Screening compound: 1-[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]-4-(2-fluorophenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3909-9403
1-[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]-4-(2-fluorophenyl)piperazine

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

3909-9403

Molecular Formula

C25H30FN5OS (C25 H30 FN5 OS)

Compound Name

1-[2,5-dimethyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]-4-(2-fluorophenyl)piperazine

IUPAC name

1-[25-dimethyl-4-(2-methylpiperidin-1-yl)thieno[23-d]pyrimidine-6-carbonyl]-4-(2-fluorophenyl)piperazine

SMILES

CC(CCCC1)N1c1c(c(C)c(C(N(CC2)CCN2c(cccc2)c2F)=O)s2)c2nc(C)n1

InChI

InChI=1S/C25H30FN5OS/c1-16-8-6-7-11-31(16)23-21-17(2)22(33-24(21)28-18(3)27-23)25(32)30-14-12-29(13-15-30)20-10-5-4-9-19(20)26/h4-5,9-10,16H,6-8,11-15H2,1-3H3/t16-/m0/s1

InChI Key

CDSDNZNPKMEGGK-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14709226

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.61

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.033

Distribution Coefficient, logD

4.151

Water Solubility, LogSw

-4.80

Polar Surface Area

41.805

Acid Dissociation Constant (pKa)

19.59

Base Dissociation Constant (pKb)

8.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

3909-9403 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Targeted Diversity Library (40567 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 3909-9403 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3909-9403?
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What is the minimum amount of 3909-9403 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3909-9403
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3909-9403
  • 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 3909-9403 available by request