3019-0467 Screening compound: N-(4-bromophenyl)-2-chloro-5-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)benzamide

3019-0467 Screening compound: N-(4-bromophenyl)-2-chloro-5-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)benzamide
3019-0467 Screening compound: N-(4-bromophenyl)-2-chloro-5-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3019-0467
N-(4-bromophenyl)-2-chloro-5-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)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

3019-0467

Molecular Formula

C22H18BrClN2O3S (C22 H18 BrClN2 O3 S)

Compound Name

N-(4-bromophenyl)-2-chloro-5-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)benzamide

IUPAC name

N-(4-bromophenyl)-2-chloro-5-(1234-tetrahydroquinoline-1-sulfonyl)benzamide

SMILES

O=C(c(cc(cc1)S(N(CCC2)c3c2cccc3)(=O)=O)c1Cl)Nc(cc1)ccc1Br

InChI

InChI=1S/C22H18BrClN2O3S/c23-16-7-9-17(10-8-16)25-22(27)19-14-18(11-12-20(19)24)30(28,29)26-13-3-5-15-4-1-2-6-21(15)26/h1-2,4,6-12,14H,3,5,13H2,(H,25,27)

InChI Key

XEDLHMWJNPVZGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14708406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

505.82

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.530

Distribution Coefficient, logD

5.425

Water Solubility, LogSw

-5.96

Polar Surface Area

54.482

Acid Dissociation Constant (pKa)

7.97

Base Dissociation Constant (pKb)

-3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

3019-0467 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3019-0467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3019-0467?
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What is the minimum amount of 3019-0467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3019-0467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3019-0467
  • 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 3019-0467 available by request