C779-0392 Screening compound: N-(3-ethoxypropyl)-1-[(4-ethyl-4H-thieno[3,2-b]pyrrol-5-yl)carbonyl]-3-piperidinecarboxamide

C779-0392 Screening compound: N-(3-ethoxypropyl)-1-[(4-ethyl-4H-thieno[3,2-b]pyrrol-5-yl)carbonyl]-3-piperidinecarboxamide
C779-0392 Screening compound: N-(3-ethoxypropyl)-1-[(4-ethyl-4H-thieno[3,2-b]pyrrol-5-yl)carbonyl]-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C779-0392
N-(3-ethoxypropyl)-1-[(4-ethyl-4H-thieno[3,2-b]pyrrol-5-yl)carbonyl]-3-piperidinecarboxamide

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

C779-0392

Molecular Formula

C20H29N3O3S (C20 H29 N3 O3 S)

Compound Name

N-(3-ethoxypropyl)-1-[(4-ethyl-4H-thieno[3,2-b]pyrrol-5-yl)carbonyl]-3-piperidinecarboxamide

IUPAC name

N-(3-ethoxypropyl)-1-{4-ethyl-4H-thieno[32-b]pyrrole-5-carbonyl}piperidine-3-carboxamide

SMILES

CCn(c(C(N(CCC1)CC1C(NCCCOCC)=O)=O)c1)c2c1scc2

InChI

InChI=1S/C20H29N3O3S/c1-3-23-16-8-12-27-18(16)13-17(23)20(25)22-10-5-7-15(14-22)19(24)21-9-6-11-26-4-2/h8,12-13,15H,3-7,9-11,14H2,1-2H3,(H,21,24)

InChI Key

JIRWRKPCTNYKNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14793733

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.379

Distribution Coefficient, logD

2.379

Water Solubility, LogSw

-2.82

Polar Surface Area

50.793

Acid Dissociation Constant (pKa)

15.00

Base Dissociation Constant (pKb)

3.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.00

C779-0392 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C779-0392 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C779-0392?
Check Price and Availability of C779-0392, 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 C779-0392 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C779-0392
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C779-0392
  • 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 C779-0392 available by request