1970-0065 Screening compound: 2-[(2-nitrophenyl)sulfonyl]-1lambda~6~-naphtho[1,8-cd]isothiazole-1,1(2H)-dione

1970-0065 Screening compound: 2-[(2-nitrophenyl)sulfonyl]-1lambda~6~-naphtho[1,8-cd]isothiazole-1,1(2H)-dione
1970-0065 Screening compound: 2-[(2-nitrophenyl)sulfonyl]-1lambda~6~-naphtho[1,8-cd]isothiazole-1,1(2H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 1970-0065
2-[(2-nitrophenyl)sulfonyl]-1lambda~6~-naphtho[1,8-cd]isothiazole-1,1(2H)-dione

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

1970-0065

Molecular Formula

C16H10N2O6S2 (C16 H10 N2 O6 S2)

Compound Name

2-[(2-nitrophenyl)sulfonyl]-1lambda~6~-naphtho[1,8-cd]isothiazole-1,1(2H)-dione

IUPAC name

3-(2-nitrobenzenesulfonyl)-2lambda6-thia-3-azatricyclo[6.3.1.0^{412}]dodeca-1(11)468(12)9-pentaene-22-dione

SMILES

[O-][N+](c(cccc1)c1S(N(c1c(c2ccc3)c3ccc1)S2(=O)=O)(=O)=O)=O

InChI

InChI=1S/C16H10N2O6S2/c19-17(20)12-7-1-2-9-14(12)25(21,22)18-13-8-3-5-11-6-4-10-15(16(11)13)26(18,23)24/h1-10H

InChI Key

KVIMCKKVUVPQLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01108144

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.4

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.929

Distribution Coefficient, logD

2.929

Water Solubility, LogSw

-3.68

Polar Surface Area

92.905

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-26.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 1970-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1970-0065?
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What is the minimum amount of 1970-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1970-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1970-0065
  • 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 1970-0065 available by request