1682-2425 Screening compound: methyl 2-[(4-bromophenyl)formamido]-3-(1H-indol-3-yl)propanoate

1682-2425 Screening compound: methyl 2-[(4-bromophenyl)formamido]-3-(1H-indol-3-yl)propanoate
1682-2425 Screening compound: methyl 2-[(4-bromophenyl)formamido]-3-(1H-indol-3-yl)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-2425
methyl 2-[(4-bromophenyl)formamido]-3-(1H-indol-3-yl)propanoate

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

1682-2425

Molecular Formula

C19H17BrN2O3 (C19 H17 BrN2 O3)

Compound Name

methyl 2-[(4-bromophenyl)formamido]-3-(1H-indol-3-yl)propanoate

IUPAC name

methyl 2-[(4-bromophenyl)formamido]-3-(1H-indol-3-yl)propanoate

SMILES

COC(C(Cc1c[nH]c2c1cccc2)NC(c(cc1)ccc1Br)=O)=O

InChI

InChI=1S/C19H17BrN2O3/c1-25-19(24)17(22-18(23)12-6-8-14(20)9-7-12)10-13-11-21-16-5-3-2-4-15(13)16/h2-9,11,17,21H,10H2,1H3,(H,22,23)/t17-/m0/s1

InChI Key

OZCVNYGMHQVRGC-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD00573179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.642

Distribution Coefficient, logD

3.642

Water Solubility, LogSw

-4.01

Polar Surface Area

55.327

Acid Dissociation Constant (pKa)

10.72

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.80

1682-2425 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1682-2425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-2425?
Check Price and Availability of 1682-2425, 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 1682-2425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-2425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-2425
  • 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 1682-2425 available by request