L251-0235 Screening compound: N-[2-(azepan-1-yl)ethyl]-2-{1-[4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carbonyl]piperidin-4-yl}propanamide

L251-0235 Screening compound: N-[2-(azepan-1-yl)ethyl]-2-{1-[4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carbonyl]piperidin-4-yl}propanamide
L251-0235 Screening compound: N-[2-(azepan-1-yl)ethyl]-2-{1-[4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carbonyl]piperidin-4-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L251-0235
N-[2-(azepan-1-yl)ethyl]-2-{1-[4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carbonyl]piperidin-4-yl}propanamide

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

L251-0235

Molecular Formula

C28H40N4O2S (C28 H40 N4 O2 S)

Compound Name

N-[2-(azepan-1-yl)ethyl]-2-{1-[4-methyl-2-(4-methylphenyl)-1,3-thiazole-5-carbonyl]piperidin-4-yl}propanamide

IUPAC name

N-[2-(azepan-1-yl)ethyl]-2-{1-[4-methyl-2-(4-methylphenyl)-13-thiazole-5-carbonyl]piperidin-4-yl}propanamide

SMILES

CC(C(CC1)CCN1C(c1c(C)nc(-c2ccc(C)cc2)s1)=O)C(NCCN1CCCCCC1)=O

InChI

InChI=1S/C28H40N4O2S/c1-20-8-10-24(11-9-20)27-30-22(3)25(35-27)28(34)32-17-12-23(13-18-32)21(2)26(33)29-14-19-31-15-6-4-5-7-16-31/h8-11,21,23H,4-7,12-19H2,1-3H3,(H,29,33)/t21-/m0/s1

InChI Key

DXOQBAVLLUCLPD-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27238077

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.725

Distribution Coefficient, logD

2.943

Water Solubility, LogSw

-4.20

Polar Surface Area

55.766

Acid Dissociation Constant (pKa)

13.35

Base Dissociation Constant (pKb)

9.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.70

L251-0235 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

MCL1 Targeted Library (12200 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Nervous system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Ion Channels
  • Phosphatases

References: we are preparing a list of scientific research reports with L251-0235 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L251-0235?
Check Price and Availability of L251-0235, 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 L251-0235 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L251-0235
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L251-0235
  • 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 L251-0235 available by request