L629-0453 Screening compound: N-cycloheptyl-2-[1-(thiophene-2-sulfonyl)piperidin-4-yl]propanamide

L629-0453 Screening compound: N-cycloheptyl-2-[1-(thiophene-2-sulfonyl)piperidin-4-yl]propanamide
L629-0453 Screening compound: N-cycloheptyl-2-[1-(thiophene-2-sulfonyl)piperidin-4-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L629-0453
N-cycloheptyl-2-[1-(thiophene-2-sulfonyl)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

L629-0453

Molecular Formula

C19H30N2O3S2 (C19 H30 N2 O3 S2)

Compound Name

N-cycloheptyl-2-[1-(thiophene-2-sulfonyl)piperidin-4-yl]propanamide

IUPAC name

N-cycloheptyl-2-[1-(thiophene-2-sulfonyl)piperidin-4-yl]propanamide

SMILES

CC(C(CC1)CCN1S(c1cccs1)(=O)=O)C(NC1CCCCCC1)=O

InChI

InChI=1S/C19H30N2O3S2/c1-15(19(22)20-17-7-4-2-3-5-8-17)16-10-12-21(13-11-16)26(23,24)18-9-6-14-25-18/h6,9,14-17H,2-5,7-8,10-13H2,1H3,(H,20,22)/t15-/m0/s1

InChI Key

GSPGTIWSKXQEEQ-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27466383

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.752

Distribution Coefficient, logD

3.752

Water Solubility, LogSw

-3.76

Polar Surface Area

57.437

Acid Dissociation Constant (pKa)

14.37

Base Dissociation Constant (pKb)

4.01

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

73.70

L629-0453 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L629-0453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L629-0453?
Check Price and Availability of L629-0453, 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 L629-0453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L629-0453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L629-0453
  • 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 L629-0453 available by request