Y043-5599 Screening compound: (2S)-4-methyl-2-(1H-pyrrol-1-yl)-N-[5-(trifluoromethyl)-2-pyridyl]pentanamide

Y043-5599 Screening compound: (2S)-4-methyl-2-(1H-pyrrol-1-yl)-N-[5-(trifluoromethyl)-2-pyridyl]pentanamide
Y043-5599 Screening compound: (2S)-4-methyl-2-(1H-pyrrol-1-yl)-N-[5-(trifluoromethyl)-2-pyridyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y043-5599
(2S)-4-methyl-2-(1H-pyrrol-1-yl)-N-[5-(trifluoromethyl)-2-pyridyl]pentanamide

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

Y043-5599

Molecular Formula

C16H18F3N3O (C16 H18 F3 N3 O)

Compound Name

(2S)-4-methyl-2-(1H-pyrrol-1-yl)-N-[5-(trifluoromethyl)-2-pyridyl]pentanamide

IUPAC name

(2S)-4-methyl-2-(1H-pyrrol-1-yl)-N-[5-(trifluoromethyl)pyridin-2-yl]pentanamide

SMILES

CC(C)CC(C(Nc1ncc(C(F)(F)F)cc1)=O)n1cccc1

InChI

InChI=1S/C16H18F3N3O/c1-11(2)9-13(22-7-3-4-8-22)15(23)21-14-6-5-12(10-20-14)16(17,18)19/h3-8,10-11,13H,9H2,1-2H3,(H,20,21,23)/t13-/m0/s1

InChI Key

CHKDCQAXLGPCHN-ZDUSSCGKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.33

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.159

Distribution Coefficient, logD

4.158

Water Solubility, LogSw

-4.03

Polar Surface Area

36.828

Acid Dissociation Constant (pKa)

9.95

Base Dissociation Constant (pKb)

-0.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

Y043-5599 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y043-5599 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y043-5599?
Check Price and Availability of Y043-5599, 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 Y043-5599 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y043-5599
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y043-5599
  • 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 Y043-5599 available by request