1488-1065 Screening compound: 1-{[(4-chlorobenzenesulfonyl)carbamoyl]amino}-N-(4-methylbenzenesulfonyl)-N-pentylformamide

1488-1065 Screening compound: 1-{[(4-chlorobenzenesulfonyl)carbamoyl]amino}-N-(4-methylbenzenesulfonyl)-N-pentylformamide
1488-1065 Screening compound: 1-{[(4-chlorobenzenesulfonyl)carbamoyl]amino}-N-(4-methylbenzenesulfonyl)-N-pentylformamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1488-1065
1-{[(4-chlorobenzenesulfonyl)carbamoyl]amino}-N-(4-methylbenzenesulfonyl)-N-pentylformamide

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

1488-1065

Molecular Formula

C20H24ClN3O6S2 (C20 H24 ClN3 O6 S2)

Compound Name

1-{[(4-chlorobenzenesulfonyl)carbamoyl]amino}-N-(4-methylbenzenesulfonyl)-N-pentylformamide

IUPAC name

1-{[(4-chlorobenzenesulfonyl)carbamoyl]amino}-N-(4-methylbenzenesulfonyl)-N-pentylformamide

SMILES

CCCCCN(C(NC(NS(c(cc1)ccc1Cl)(=O)=O)=O)=O)S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C20H24ClN3O6S2/c1-3-4-5-14-24(32(29,30)18-10-6-15(2)7-11-18)20(26)22-19(25)23-31(27,28)17-12-8-16(21)9-13-17/h6-13H,3-5,14H2,1-2H3,(H2,22,23,25,26)

InChI Key

AOXMOYBGZQRZLU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

502.01

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.485

Distribution Coefficient, logD

-1.068

Water Solubility, LogSw

-4.55

Polar Surface Area

109.187

Acid Dissociation Constant (pKa)

1.85

Base Dissociation Constant (pKb)

-11.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

1488-1065 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Mimetics
Mechanism of action:
  • PPI modulators
  • Epigenetic
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with 1488-1065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1488-1065?
Check Price and Availability of 1488-1065, 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 1488-1065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1488-1065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1488-1065
  • 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 1488-1065 available by request