4448-0570 Screening compound: (5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione

4448-0570 Screening compound: (5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione
4448-0570 Screening compound: (5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4448-0570
(5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione

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

4448-0570

Molecular Formula

C18H12BrClN2O4 (C18 H12 BrClN2 O4)

Compound Name

(5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]imidazolidine-2,4-dione

IUPAC name

(5E)-3-[(4-bromophenyl)methyl]-5-[(6-chloro-2H-13-benzodioxol-5-yl)methylidene]imidazolidine-24-dione

SMILES

O=C(/C(/N1)=C\c(cc2OCOc2c2)c2Cl)N(Cc(cc2)ccc2Br)C1=O

InChI

InChI=1S/C18H12BrClN2O4/c19-12-3-1-10(2-4-12)8-22-17(23)14(21-18(22)24)5-11-6-15-16(7-13(11)20)26-9-25-15/h1-7H,8-9H2,(H,21,24)

InChI Key

RAHFQBZJDVSYMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03141253

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.66

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.556

Distribution Coefficient, logD

4.556

Water Solubility, LogSw

-4.65

Polar Surface Area

57.786

Acid Dissociation Constant (pKa)

10.57

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with 4448-0570 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4448-0570?
Check Price and Availability of 4448-0570, 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 4448-0570 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4448-0570
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4448-0570
  • 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 4448-0570 available by request