F602-2029 Screening compound: propan-2-yl 5-(3-{[(4-ethylphenyl)methyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

F602-2029 Screening compound: propan-2-yl 5-(3-{[(4-ethylphenyl)methyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
F602-2029 Screening compound: propan-2-yl 5-(3-{[(4-ethylphenyl)methyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F602-2029
propan-2-yl 5-(3-{[(4-ethylphenyl)methyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

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

F602-2029

Molecular Formula

C26H35N3O4 (C26 H35 N3 O4)

Compound Name

propan-2-yl 5-(3-{[(4-ethylphenyl)methyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

propan-2-yl 5-(3-{[(4-ethylphenyl)methyl]carbamoyl}piperidine-1-carbonyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCc1ccc(CNC(C(CCC2)CN2C(c2c(C)c(C(OC(C)C)=O)c(C)[nH]2)=O)=O)cc1

InChI

InChI=1S/C26H35N3O4/c1-6-19-9-11-20(12-10-19)14-27-24(30)21-8-7-13-29(15-21)25(31)23-17(4)22(18(5)28-23)26(32)33-16(2)3/h9-12,16,21,28H,6-8,13-15H2,1-5H3,(H,27,30)/t21-/m0/s1

InChI Key

AYARYTOXUGVLAN-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27178975

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.761

Distribution Coefficient, logD

3.761

Water Solubility, LogSw

-4.03

Polar Surface Area

72.648

Acid Dissociation Constant (pKa)

12.49

Base Dissociation Constant (pKb)

-1.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

F602-2029 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with F602-2029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F602-2029?
Check Price and Availability of F602-2029, 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 F602-2029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F602-2029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F602-2029
  • 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 F602-2029 available by request