1582-0028 Screening compound: ethyl 4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate

1582-0028 Screening compound: ethyl 4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate
1582-0028 Screening compound: ethyl 4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1582-0028
ethyl 4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate

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

1582-0028

Molecular Formula

C15H12N4O5 (C15 H12 N4 O5)

Compound Name

ethyl 4-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]benzoate

IUPAC name

ethyl 4-[(7-nitro-213-benzoxadiazol-4-yl)amino]benzoate

SMILES

CCOC(c(cc1)ccc1Nc(c1nonc11)ccc1[N+]([O-])=O)=O

InChI

InChI=1S/C15H12N4O5/c1-2-23-15(20)9-3-5-10(6-4-9)16-11-7-8-12(19(21)22)14-13(11)17-24-18-14/h3-8,16H,2H2,1H3

InChI Key

GMGBDVYOWVIZTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00576794

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.453

Distribution Coefficient, logD

4.453

Water Solubility, LogSw

-4.28

Polar Surface Area

99.148

Acid Dissociation Constant (pKa)

15.71

Base Dissociation Constant (pKb)

-5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

References: we are preparing a list of scientific research reports with 1582-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1582-0028?
Check Price and Availability of 1582-0028, 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 1582-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1582-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1582-0028
  • 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 1582-0028 available by request