1606-0090 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 3-[(2,3-dichlorophenyl)carbamoyl]propanoate

1606-0090 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 3-[(2,3-dichlorophenyl)carbamoyl]propanoate
1606-0090 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 3-[(2,3-dichlorophenyl)carbamoyl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1606-0090
2-(4-bromophenyl)-2-oxoethyl 3-[(2,3-dichlorophenyl)carbamoyl]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

1606-0090

Molecular Formula

C18H14BrCl2NO4 (C18 H14 BrCl2 NO4)

Compound Name

2-(4-bromophenyl)-2-oxoethyl 3-[(2,3-dichlorophenyl)carbamoyl]propanoate

IUPAC name

2-(4-bromophenyl)-2-oxoethyl 3-[(23-dichlorophenyl)carbamoyl]propanoate

SMILES

O=C(COC(CCC(Nc(cccc1Cl)c1Cl)=O)=O)c(cc1)ccc1Br

InChI

InChI=1S/C18H14BrCl2NO4/c19-12-6-4-11(5-7-12)15(23)10-26-17(25)9-8-16(24)22-14-3-1-2-13(20)18(14)21/h1-7H,8-10H2,(H,22,24)

InChI Key

QCABMCOYDWAEII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01024814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.12

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.321

Distribution Coefficient, logD

4.299

Water Solubility, LogSw

-4.41

Polar Surface Area

56.200

Acid Dissociation Constant (pKa)

8.69

Base Dissociation Constant (pKb)

-2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

1606-0090 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 1606-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1606-0090?
Check Price and Availability of 1606-0090, 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 1606-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1606-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1606-0090
  • 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 1606-0090 available by request