5593-1966 Screening compound: 1-[1-(4-bromo-3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide

5593-1966 Screening compound: 1-[1-(4-bromo-3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide
5593-1966 Screening compound: 1-[1-(4-bromo-3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5593-1966
1-[1-(4-bromo-3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide

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

5593-1966

Molecular Formula

C16H17BrClN3O3 (C16 H17 BrClN3 O3)

Compound Name

1-[1-(4-bromo-3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxamide

IUPAC name

1-[1-(4-bromo-3-chlorophenyl)-25-dioxopyrrolidin-3-yl]piperidine-4-carboxamide

SMILES

NC(C(CC1)CCN1C(CC(N1c(cc2)cc(Cl)c2Br)=O)C1=O)=O

InChI

InChI=1S/C16H17BrClN3O3/c17-11-2-1-10(7-12(11)18)21-14(22)8-13(16(21)24)20-5-3-9(4-6-20)15(19)23/h1-2,7,9,13H,3-6,8H2,(H2,19,23)/t13-/m1/s1

InChI Key

BNDSIOIWZLZPMI-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD02646735

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.69

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.895

Distribution Coefficient, logD

0.893

Water Solubility, LogSw

-2.29

Polar Surface Area

66.047

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

5.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.80

References: we are preparing a list of scientific research reports with 5593-1966 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5593-1966?
Check Price and Availability of 5593-1966, 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 5593-1966 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5593-1966
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5593-1966
  • 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 5593-1966 available by request