2318-0294 Screening compound: methyl 5-[N-(4-chloro-3-nitrobenzenesulfonyl)acetamido]-2-methyl-1-benzofuran-3-carboxylate

2318-0294 Screening compound: methyl 5-[N-(4-chloro-3-nitrobenzenesulfonyl)acetamido]-2-methyl-1-benzofuran-3-carboxylate
2318-0294 Screening compound: methyl 5-[N-(4-chloro-3-nitrobenzenesulfonyl)acetamido]-2-methyl-1-benzofuran-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2318-0294
methyl 5-[N-(4-chloro-3-nitrobenzenesulfonyl)acetamido]-2-methyl-1-benzofuran-3-carboxylate

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

2318-0294

Molecular Formula

C19H15ClN2O8S (C19 H15 ClN2 O8 S)

Compound Name

methyl 5-[N-(4-chloro-3-nitrobenzenesulfonyl)acetamido]-2-methyl-1-benzofuran-3-carboxylate

IUPAC name

methyl 5-[N-(4-chloro-3-nitrobenzenesulfonyl)acetamido]-2-methyl-1-benzofuran-3-carboxylate

SMILES

CC(N(c(cc1)cc2c1oc(C)c2C(OC)=O)S(c(cc1)cc([N+]([O-])=O)c1Cl)(=O)=O)=O

InChI

InChI=1S/C19H15ClN2O8S/c1-10-18(19(24)29-3)14-8-12(4-7-17(14)30-10)21(11(2)23)31(27,28)13-5-6-15(20)16(9-13)22(25)26/h4-9H,1-3H3

InChI Key

UVAAQNVLQXMXLV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01841000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.86

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.389

Distribution Coefficient, logD

3.389

Water Solubility, LogSw

-4.35

Polar Surface Area

108.487

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

-17.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 2318-0294 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2318-0294?
Check Price and Availability of 2318-0294, 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 2318-0294 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2318-0294
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2318-0294
  • 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 2318-0294 available by request