8602-0359 Screening compound: N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2-methoxybenzamide

8602-0359 Screening compound: N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2-methoxybenzamide
8602-0359 Screening compound: N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8602-0359
N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2-methoxybenzamide

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

8602-0359

Molecular Formula

C19H16F3N3O4 (C19 H16 F3 N3 O4)

Compound Name

N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2-methoxybenzamide

IUPAC name

N-[1-benzyl-25-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-2-methoxybenzamide

SMILES

COc(cccc1)c1C(NC(C(F)(F)F)(C(N1Cc2ccccc2)=O)NC1=O)=O

InChI

InChI=1S/C19H16F3N3O4/c1-29-14-10-6-5-9-13(14)15(26)23-18(19(20,21)22)16(27)25(17(28)24-18)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3,(H,23,26)(H,24,28)/t18-/m1/s1

InChI Key

PWFRVMSAOAAEIM-GOSISDBHSA-N

MDL Number (MFCD)

MFCD08098319

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.834

Distribution Coefficient, logD

0.104

Water Solubility, LogSw

-3.68

Polar Surface Area

73.428

Acid Dissociation Constant (pKa)

4.67

Base Dissociation Constant (pKb)

-8.50

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.10

8602-0359 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8602-0359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8602-0359?
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What is the minimum amount of 8602-0359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8602-0359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8602-0359
  • 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 8602-0359 available by request