7673-0037 Screening compound: 1-{2-[4-(diethylamino)phenyl]-5-methyl-3-(4-methylbenzenesulfonyl)imidazolidin-1-yl}-2,2,2-trifluoroethan-1-one

7673-0037 Screening compound: 1-{2-[4-(diethylamino)phenyl]-5-methyl-3-(4-methylbenzenesulfonyl)imidazolidin-1-yl}-2,2,2-trifluoroethan-1-one
7673-0037 Screening compound: 1-{2-[4-(diethylamino)phenyl]-5-methyl-3-(4-methylbenzenesulfonyl)imidazolidin-1-yl}-2,2,2-trifluoroethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7673-0037
1-{2-[4-(diethylamino)phenyl]-5-methyl-3-(4-methylbenzenesulfonyl)imidazolidin-1-yl}-2,2,2-trifluoroethan-1-one

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

7673-0037

Molecular Formula

C23H28F3N3O3S (C23 H28 F3 N3 O3 S)

Compound Name

1-{2-[4-(diethylamino)phenyl]-5-methyl-3-(4-methylbenzenesulfonyl)imidazolidin-1-yl}-2,2,2-trifluoroethan-1-one

IUPAC name

1-{2-[4-(diethylamino)phenyl]-5-methyl-3-(4-methylbenzenesulfonyl)imidazolidin-1-yl}-222-trifluoroethan-1-one

SMILES

CCN(CC)c1ccc(C(N(CC2C)S(c3ccc(C)cc3)(=O)=O)N2C(C(F)(F)F)=O)cc1

InChI

InChI=1S/C23H28F3N3O3S/c1-5-27(6-2)19-11-9-18(10-12-19)21-28(15-17(4)29(21)22(30)23(24,25)26)33(31,32)20-13-7-16(3)8-14-20/h7-14,17,21H,5-6,15H2,1-4H3

InChI Key

YBAJZEIEQTUPJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07039026

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.889

Distribution Coefficient, logD

4.554

Water Solubility, LogSw

-4.55

Polar Surface Area

50.298

Acid Dissociation Constant (pKa)

25.57

Base Dissociation Constant (pKb)

7.47

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

43.50

7673-0037 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 7673-0037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7673-0037?
Check Price and Availability of 7673-0037, 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 7673-0037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7673-0037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7673-0037
  • 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 7673-0037 available by request