S578-0905 Screening compound: (2R,4S)-N-(2-methoxyethyl)-N-propyl-4-(3-pyridyloxy)tetrahydro-1H-pyrrole-1,2-dicarboxamide

S578-0905 Screening compound: (2R,4S)-N-(2-methoxyethyl)-N-propyl-4-(3-pyridyloxy)tetrahydro-1H-pyrrole-1,2-dicarboxamide
S578-0905 Screening compound: (2R,4S)-N-(2-methoxyethyl)-N-propyl-4-(3-pyridyloxy)tetrahydro-1H-pyrrole-1,2-dicarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S578-0905
(2R,4S)-N-(2-methoxyethyl)-N-propyl-4-(3-pyridyloxy)tetrahydro-1H-pyrrole-1,2-dicarboxamide

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

S578-0905

Molecular Formula

C17H26N4O4 (C17 H26 N4 O4)

Compound Name

(2R,4S)-N-(2-methoxyethyl)-N-propyl-4-(3-pyridyloxy)tetrahydro-1H-pyrrole-1,2-dicarboxamide

IUPAC name

n/a

SMILES

CCCNC(N(C[C@H](C1)Oc2cnccc2)[C@H]1C(NCCOC)=O)=O

InChI

InChI=1S/C17H26N4O4/c1-3-6-20-17(23)21-12-14(25-13-5-4-7-18-11-13)10-15(21)16(22)19-8-9-24-2/h4-5,7,11,14-15H,3,6,8-10,12H2,1-2H3,(H,19,22)(H,20,23)/t14-,15-/m1/s1

InChI Key

HBJWESIYXTVPEP-HUUCEWRRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.916

Distribution Coefficient, logD

0.904

Water Solubility, LogSw

-1.11

Polar Surface Area

75.784

Acid Dissociation Constant (pKa)

14.28

Base Dissociation Constant (pKb)

5.85

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

58.82

S578-0905 in Drug Discovery

Included in Screening Libraries

Natural-Product-Based Library (3730 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with S578-0905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S578-0905?
Check Price and Availability of S578-0905, 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 S578-0905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S578-0905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S578-0905
  • 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 S578-0905 available by request