P207-8799 Screening compound: 2-methyl-3-[(piperidin-1-yl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxylic acid

P207-8799 Screening compound: 2-methyl-3-[(piperidin-1-yl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxylic acid
P207-8799 Screening compound: 2-methyl-3-[(piperidin-1-yl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound P207-8799
2-methyl-3-[(piperidin-1-yl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxylic acid

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

P207-8799

Molecular Formula

C14H18N2O2S (C14 H18 N2 O2 S)

Compound Name

2-methyl-3-[(piperidin-1-yl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxylic acid

IUPAC name

2-methyl-3-[(piperidin-1-yl)methyl]-4H-thieno[32-b]pyrrole-5-carboxylic acid

SMILES

Cc1c(CN2CCCCC2)c([nH]c(C(O)=O)c2)c2s1

InChI

InChI=1S/C14H18N2O2S/c1-9-10(8-16-5-3-2-4-6-16)13-12(19-9)7-11(15-13)14(17)18/h7,15H,2-6,8H2,1H3,(H,17,18)

InChI Key

QGNICZIBMUXWBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28897947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.508

Distribution Coefficient, logD

2.508

Water Solubility, LogSw

-2.36

Polar Surface Area

43.517

Acid Dissociation Constant (pKa)

4.74

Base Dissociation Constant (pKb)

8.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P207-8799 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Fragment Library (4274 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with P207-8799 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P207-8799?
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What is the minimum amount of P207-8799 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P207-8799
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P207-8799
  • 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 P207-8799 available by request