5983-1337 Screening compound: 2-amino-4-{2-[(4-bromophenyl)methoxy]phenyl}-7-hydroxy-4H-chromene-3-carbonitrile

5983-1337 Screening compound: 2-amino-4-{2-[(4-bromophenyl)methoxy]phenyl}-7-hydroxy-4H-chromene-3-carbonitrile
5983-1337 Screening compound: 2-amino-4-{2-[(4-bromophenyl)methoxy]phenyl}-7-hydroxy-4H-chromene-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 5983-1337
2-amino-4-{2-[(4-bromophenyl)methoxy]phenyl}-7-hydroxy-4H-chromene-3-carbonitrile

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

5983-1337

Molecular Formula

C23H17BrN2O3 (C23 H17 BrN2 O3)

Compound Name

2-amino-4-{2-[(4-bromophenyl)methoxy]phenyl}-7-hydroxy-4H-chromene-3-carbonitrile

IUPAC name

2-amino-4-{2-[(4-bromophenyl)methoxy]phenyl}-7-hydroxy-4H-chromene-3-carbonitrile

SMILES

NC(Oc1c(C2c(cccc3)c3OCc(cc3)ccc3Br)ccc(O)c1)=C2C#N

InChI

InChI=1S/C23H17BrN2O3/c24-15-7-5-14(6-8-15)13-28-20-4-2-1-3-17(20)22-18-10-9-16(27)11-21(18)29-23(26)19(22)12-25/h1-11,22,27H,13,26H2/t22-/m0/s1

InChI Key

NXOXYOJIVGEBPP-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD05150110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.807

Distribution Coefficient, logD

4.807

Water Solubility, LogSw

-4.88

Polar Surface Area

71.225

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

-1.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

8.70

5983-1337 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiparasite Library (23996 compounds)

BRD4 Targeted Library (4534 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Immune system
  • animal
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with 5983-1337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5983-1337?
Check Price and Availability of 5983-1337, 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 5983-1337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5983-1337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5983-1337
  • 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 5983-1337 available by request