J014-1843 Screening compound: 4-(benzenesulfonyl)-6-chloro-2-(1,2,3,4-tetrahydroquinoline-1-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine

J014-1843 Screening compound: 4-(benzenesulfonyl)-6-chloro-2-(1,2,3,4-tetrahydroquinoline-1-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine
J014-1843 Screening compound: 4-(benzenesulfonyl)-6-chloro-2-(1,2,3,4-tetrahydroquinoline-1-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound J014-1843
4-(benzenesulfonyl)-6-chloro-2-(1,2,3,4-tetrahydroquinoline-1-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine

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

J014-1843

Molecular Formula

C24H21ClN2O4S (C24 H21 ClN2 O4 S)

Compound Name

4-(benzenesulfonyl)-6-chloro-2-(1,2,3,4-tetrahydroquinoline-1-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine

IUPAC name

4-(benzenesulfonyl)-6-chloro-2-(1234-tetrahydroquinoline-1-carbonyl)-34-dihydro-2H-14-benzoxazine

SMILES

O=C(C(C1)Oc(ccc(Cl)c2)c2N1S(c1ccccc1)(=O)=O)N(CCC1)c2c1cccc2

InChI

InChI=1S/C24H21ClN2O4S/c25-18-12-13-22-21(15-18)27(32(29,30)19-9-2-1-3-10-19)16-23(31-22)24(28)26-14-6-8-17-7-4-5-11-20(17)26/h1-5,7,9-13,15,23H,6,8,14,16H2/t23-/m1/s1

InChI Key

BBTMOPGWAZPGBM-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD27217461

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.96

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.528

Distribution Coefficient, logD

4.528

Water Solubility, LogSw

-4.68

Polar Surface Area

53.704

Acid Dissociation Constant (pKa)

17.58

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

J014-1843 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with J014-1843 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J014-1843?
Check Price and Availability of J014-1843, 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 J014-1843 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J014-1843
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J014-1843
  • 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 J014-1843 available by request