D630-0051 Screening compound: 5-chloro-2-methoxy-N-[2-phenyl-2-(thiophene-2-sulfonyl)ethyl]benzene-1-sulfonamide

D630-0051 Screening compound: 5-chloro-2-methoxy-N-[2-phenyl-2-(thiophene-2-sulfonyl)ethyl]benzene-1-sulfonamide
D630-0051 Screening compound: 5-chloro-2-methoxy-N-[2-phenyl-2-(thiophene-2-sulfonyl)ethyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D630-0051
5-chloro-2-methoxy-N-[2-phenyl-2-(thiophene-2-sulfonyl)ethyl]benzene-1-sulfonamide

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

D630-0051

Molecular Formula

C19H18ClNO5S3 (C19 H18 ClNO5 S3)

Compound Name

5-chloro-2-methoxy-N-[2-phenyl-2-(thiophene-2-sulfonyl)ethyl]benzene-1-sulfonamide

IUPAC name

5-chloro-2-methoxy-N-[2-phenyl-2-(thiophene-2-sulfonyl)ethyl]benzene-1-sulfonamide

SMILES

COc(ccc(Cl)c1)c1S(NCC(c1ccccc1)S(c1cccs1)(=O)=O)(=O)=O

InChI

InChI=1S/C19H18ClNO5S3/c1-26-16-10-9-15(20)12-17(16)29(24,25)21-13-18(14-6-3-2-4-7-14)28(22,23)19-8-5-11-27-19/h2-12,18,21H,13H2,1H3/t18-/m0/s1

InChI Key

KVRSHXPLYPAIMG-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15142471

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.01

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.917

Distribution Coefficient, logD

3.917

Water Solubility, LogSw

-4.32

Polar Surface Area

80.146

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

-8.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.80

D630-0051 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D630-0051 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D630-0051?
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What is the minimum amount of D630-0051 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D630-0051
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D630-0051
  • 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 D630-0051 available by request