8007-0582 Screening compound: 2-(4-methoxy-3-nitrophenyl)-3-(4-methoxybenzenesulfonyl)-1,3-thiazolidine

8007-0582 Screening compound: 2-(4-methoxy-3-nitrophenyl)-3-(4-methoxybenzenesulfonyl)-1,3-thiazolidine
8007-0582 Screening compound: 2-(4-methoxy-3-nitrophenyl)-3-(4-methoxybenzenesulfonyl)-1,3-thiazolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-0582
2-(4-methoxy-3-nitrophenyl)-3-(4-methoxybenzenesulfonyl)-1,3-thiazolidine

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

8007-0582

Molecular Formula

C17H18N2O6S2 (C17 H18 N2 O6 S2)

Compound Name

2-(4-methoxy-3-nitrophenyl)-3-(4-methoxybenzenesulfonyl)-1,3-thiazolidine

IUPAC name

2-(4-methoxy-3-nitrophenyl)-3-(4-methoxybenzenesulfonyl)-13-thiazolidine

SMILES

COc(cc1)ccc1S(N1C(c(cc2)cc([N+]([O-])=O)c2OC)SCC1)(=O)=O

InChI

InChI=1S/C17H18N2O6S2/c1-24-13-4-6-14(7-5-13)27(22,23)18-9-10-26-17(18)12-3-8-16(25-2)15(11-12)19(20)21/h3-8,11,17H,9-10H2,1-2H3/t17-/m0/s1

InChI Key

JSIFDQCKPFEOAF-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD00828084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.47

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.917

Distribution Coefficient, logD

2.917

Water Solubility, LogSw

-3.55

Polar Surface Area

80.771

Acid Dissociation Constant (pKa)

26.34

Base Dissociation Constant (pKb)

-11.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.40

8007-0582 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with 8007-0582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-0582?
Check Price and Availability of 8007-0582, 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 8007-0582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-0582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-0582
  • 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 8007-0582 available by request