2513-2641 Screening compound: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-chloro-2-nitrobenzamide

2513-2641 Screening compound: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-chloro-2-nitrobenzamide
2513-2641 Screening compound: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-chloro-2-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2513-2641
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-chloro-2-nitrobenzamide

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

2513-2641

Molecular Formula

C16H9BrClN3O3S (C16 H9 BrClN3 O3 S)

Compound Name

N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-chloro-2-nitrobenzamide

IUPAC name

N-[4-(4-bromophenyl)-13-thiazol-2-yl]-5-chloro-2-nitrobenzamide

SMILES

[O-][N+](c(ccc(Cl)c1)c1C(Nc1nc(-c(cc2)ccc2Br)cs1)=O)=O

InChI

InChI=1S/C16H9BrClN3O3S/c17-10-3-1-9(2-4-10)13-8-25-16(19-13)20-15(22)12-7-11(18)5-6-14(12)21(23)24/h1-8H,(H,19,20,22)

InChI Key

UOUUCKRNMQQIMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01352265

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.762

Distribution Coefficient, logD

5.138

Water Solubility, LogSw

-6.03

Polar Surface Area

66.185

Acid Dissociation Constant (pKa)

6.89

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2513-2641 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiparasite Library (23996 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2513-2641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2513-2641?
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What is the minimum amount of 2513-2641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2513-2641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2513-2641
  • 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 2513-2641 available by request