2552-0148 Screening compound: 4-bromo-3-[(4-methylpiperazin-1-yl)sulfonyl]-N-(3-nitrophenyl)benzamide

2552-0148 Screening compound: 4-bromo-3-[(4-methylpiperazin-1-yl)sulfonyl]-N-(3-nitrophenyl)benzamide
2552-0148 Screening compound: 4-bromo-3-[(4-methylpiperazin-1-yl)sulfonyl]-N-(3-nitrophenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2552-0148
4-bromo-3-[(4-methylpiperazin-1-yl)sulfonyl]-N-(3-nitrophenyl)benzamide

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

2552-0148

Molecular Formula

C18H19BrN4O5S (C18 H19 BrN4 O5 S)

Compound Name

4-bromo-3-[(4-methylpiperazin-1-yl)sulfonyl]-N-(3-nitrophenyl)benzamide

IUPAC name

4-bromo-3-[(4-methylpiperazin-1-yl)sulfonyl]-N-(3-nitrophenyl)benzamide

SMILES

CN(CC1)CCN1S(c(cc(cc1)C(Nc2cc([N+]([O-])=O)ccc2)=O)c1Br)(=O)=O

InChI

InChI=1S/C18H19BrN4O5S/c1-21-7-9-22(10-8-21)29(27,28)17-11-13(5-6-16(17)19)18(24)20-14-3-2-4-15(12-14)23(25)26/h2-6,11-12H,7-10H2,1H3,(H,20,24)

InChI Key

ORQZKWGOAOLKNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01197466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.34

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.850

Distribution Coefficient, logD

2.298

Water Solubility, LogSw

-3.59

Polar Surface Area

91.899

Acid Dissociation Constant (pKa)

6.99

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

2552-0148 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 2552-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2552-0148?
Check Price and Availability of 2552-0148, 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 2552-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2552-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2552-0148
  • 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 2552-0148 available by request