P207-9044 Screening compound: 2-[(tert-butoxy)carbonyl]-5-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-octahydropyrrolo[3,4-c]pyrrole-3a-carboxylic acid

P207-9044 Screening compound: 2-[(tert-butoxy)carbonyl]-5-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-octahydropyrrolo[3,4-c]pyrrole-3a-carboxylic acid
P207-9044 Screening compound: 2-[(tert-butoxy)carbonyl]-5-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-octahydropyrrolo[3,4-c]pyrrole-3a-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound P207-9044
2-[(tert-butoxy)carbonyl]-5-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-octahydropyrrolo[3,4-c]pyrrole-3a-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

P207-9044

Molecular Formula

C32H39N3O6 (C32 H39 N3 O6)

Compound Name

2-[(tert-butoxy)carbonyl]-5-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-octahydropyrrolo[3,4-c]pyrrole-3a-carboxylic acid

IUPAC name

(3aR6aR)-2-[(tert-butoxy)carbonyl]-5-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-octahydropyrrolo[34-c]pyrrole-3a-carboxylic acid

SMILES

CC(C)(C)OC(N(C[C@@H]1CN(C2)C(CC3)CCN3C(OCC3c(cccc4)c4-c4c3cccc4)=O)C[C@@]12C(O)=O)=O

InChI

InChI=1S/C32H39N3O6/c1-31(2,3)41-30(39)35-17-21-16-34(19-32(21,20-35)28(36)37)22-12-14-33(15-13-22)29(38)40-18-27-25-10-6-4-8-23(25)24-9-5-7-11-26(24)27/h4-11,21-22,27H,12-20H2,1-3H3,(H,36,37)/t21-,32+/m1/s1

InChI Key

JXVQNQFMXJAKMU-KTBRYMIGSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

561.68

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.137

Distribution Coefficient, logD

5.137

Water Solubility, LogSw

-4.76

Polar Surface Area

77.107

Acid Dissociation Constant (pKa)

4.48

Base Dissociation Constant (pKb)

13.32

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

53.13

P207-9044 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with P207-9044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P207-9044?
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What is the minimum amount of P207-9044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P207-9044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P207-9044
  • 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 P207-9044 available by request