L628-0008 Screening compound: 1-({4-CHLORO-3-[(4-ETHYLPIPERAZIN-1-YL)CARBONYL]PHENYL}SULFONYL)AZEPANE

L628-0008 Screening compound: 1-({4-CHLORO-3-[(4-ETHYLPIPERAZIN-1-YL)CARBONYL]PHENYL}SULFONYL)AZEPANE
L628-0008 Screening compound: 1-({4-CHLORO-3-[(4-ETHYLPIPERAZIN-1-YL)CARBONYL]PHENYL}SULFONYL)AZEPANE alternative view

Chemical Structure Depiction of ChemDiv screening compound L628-0008
1-({4-CHLORO-3-[(4-ETHYLPIPERAZIN-1-YL)CARBONYL]PHENYL}SULFONYL)AZEPANE

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

L628-0008

Molecular Formula

C18H24N4O4S (C18 H24 N4 O4 S)

Compound Name

1-({4-CHLORO-3-[(4-ETHYLPIPERAZIN-1-YL)CARBONYL]PHENYL}SULFONYL)AZEPANE

IUPAC name

n/a

SMILES

Cc1noc(C)c1S(N1CCC(CC(NCc2cnccc2)=O)CC1)(=O)=O

InChI

InChI=1S/C18H24N4O4S/c1-13-18(14(2)26-21-13)27(24,25)22-8-5-15(6-9-22)10-17(23)20-12-16-4-3-7-19-11-16/h3-4,7,11,15H,5-6,8-10,12H2,1-2H3,(H,20,23)

InChI Key

OIGAIXCCBYQRFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27466152

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.638

Distribution Coefficient, logD

0.636

Water Solubility, LogSw

-1.70

Polar Surface Area

87.705

Acid Dissociation Constant (pKa)

13.61

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

L628-0008 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 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 L628-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L628-0008?
Check Price and Availability of L628-0008, 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 L628-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L628-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L628-0008
  • 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 L628-0008 available by request