P936-2566 Screening compound: CYCLOPENTYL{3-[(4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL]-1-PYRROLIDINYL}METHANONE

P936-2566 Screening compound: CYCLOPENTYL{3-[(4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL]-1-PYRROLIDINYL}METHANONE
P936-2566 Screening compound: CYCLOPENTYL{3-[(4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL]-1-PYRROLIDINYL}METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound P936-2566
CYCLOPENTYL{3-[(4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL]-1-PYRROLIDINYL}METHANONE

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

P936-2566

Molecular Formula

C15H24N4O (C15 H24 N4 O)

Compound Name

CYCLOPENTYL{3-[(4-ETHYL-4H-1,2,4-TRIAZOL-3-YL)METHYL]-1-PYRROLIDINYL}METHANONE

IUPAC name

3-[(1-cyclopentanecarbonylpyrrolidin-3-yl)methyl]-4-ethyl-4H-124-triazole

SMILES

CCn1c(CC(CC2)CN2C(C2CCCC2)=O)nnc1

InChI

InChI=1S/C15H24N4O/c1-2-18-11-16-17-14(18)9-12-7-8-19(10-12)15(20)13-5-3-4-6-13/h11-13H,2-10H2,1H3/t12-/m0/s1

InChI Key

RINQKLDACDGFKW-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD30462158

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.551

Distribution Coefficient, logD

1.550

Water Solubility, LogSw

-1.35

Polar Surface Area

42.801

Acid Dissociation Constant (pKa)

21.12

Base Dissociation Constant (pKb)

4.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

80.00

P936-2566 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
  • Cyclic compounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P936-2566 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P936-2566?
Check Price and Availability of P936-2566, 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 P936-2566 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P936-2566
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P936-2566
  • 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 P936-2566 available by request