Y031-5770 Screening compound: 1-(4-fluorobenzoyl)-N-(3-methylbutyl)piperidine-4-carboxamide

Y031-5770 Screening compound: 1-(4-fluorobenzoyl)-N-(3-methylbutyl)piperidine-4-carboxamide
Y031-5770 Screening compound: 1-(4-fluorobenzoyl)-N-(3-methylbutyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-5770
1-(4-fluorobenzoyl)-N-(3-methylbutyl)piperidine-4-carboxamide

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

Y031-5770

Molecular Formula

C18H25FN2O2 (C18 H25 FN2 O2)

Compound Name

1-(4-fluorobenzoyl)-N-(3-methylbutyl)piperidine-4-carboxamide

IUPAC name

1-(4-fluorobenzoyl)-N-(3-methylbutyl)piperidine-4-carboxamide

SMILES

CC(C)CCNC(C(CC1)CCN1C(c(cc1)ccc1F)=O)=O

InChI

InChI=1S/C18H25FN2O2/c1-13(2)7-10-20-17(22)14-8-11-21(12-9-14)18(23)15-3-5-16(19)6-4-15/h3-6,13-14H,7-12H2,1-2H3,(H,20,22)

InChI Key

SDLLUUCUYMADLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07828195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.402

Distribution Coefficient, logD

2.402

Water Solubility, LogSw

-2.74

Polar Surface Area

41.413

Acid Dissociation Constant (pKa)

13.75

Base Dissociation Constant (pKb)

5.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

Y031-5770 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with Y031-5770 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-5770?
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What is the minimum amount of Y031-5770 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-5770
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-5770
  • 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 Y031-5770 available by request