P168-0982 Screening compound: 1-propyl-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

P168-0982 Screening compound: 1-propyl-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
P168-0982 Screening compound: 1-propyl-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P168-0982
1-propyl-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

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

P168-0982

Molecular Formula

C16H17N3OS (C16 H17 N3 OS)

Compound Name

1-propyl-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

IUPAC name

1-propyl-N-[(thiophen-2-yl)methyl]-1H-pyrrolo[23-b]pyridine-3-carboxamide

SMILES

CCCn1c(nccc2)c2c(C(NCc2cccs2)=O)c1

InChI

InChI=1S/C16H17N3OS/c1-2-8-19-11-14(13-6-3-7-17-15(13)19)16(20)18-10-12-5-4-9-21-12/h3-7,9,11H,2,8,10H2,1H3,(H,18,20)

InChI Key

VXAPYIUSUQRDTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29020707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.975

Distribution Coefficient, logD

2.975

Water Solubility, LogSw

-3.19

Polar Surface Area

37.559

Acid Dissociation Constant (pKa)

14.28

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

P168-0982 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with P168-0982 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P168-0982?
Check Price and Availability of P168-0982, 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 P168-0982 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P168-0982
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P168-0982
  • 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 P168-0982 available by request