D702-0242 Screening compound: N-(3-chloro-2-methylphenyl)-2-{3-[(4-methylphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide

D702-0242 Screening compound: N-(3-chloro-2-methylphenyl)-2-{3-[(4-methylphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide
D702-0242 Screening compound: N-(3-chloro-2-methylphenyl)-2-{3-[(4-methylphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D702-0242
N-(3-chloro-2-methylphenyl)-2-{3-[(4-methylphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide

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

D702-0242

Molecular Formula

C21H20ClN3O3 (C21 H20 ClN3 O3)

Compound Name

N-(3-chloro-2-methylphenyl)-2-{3-[(4-methylphenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}acetamide

IUPAC name

N-(3-chloro-2-methylphenyl)-2-{3-[(4-methylphenyl)methyl]-26-dioxo-1236-tetrahydropyrimidin-1-yl}acetamide

SMILES

Cc1ccc(CN(C=CC(N2CC(Nc3cccc(Cl)c3C)=O)=O)C2=O)cc1

InChI

InChI=1S/C21H20ClN3O3/c1-14-6-8-16(9-7-14)12-24-11-10-20(27)25(21(24)28)13-19(26)23-18-5-3-4-17(22)15(18)2/h3-11H,12-13H2,1-2H3,(H,23,26)

InChI Key

IHAJSAXKJRRTHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.190

Distribution Coefficient, logD

3.190

Water Solubility, LogSw

-3.39

Polar Surface Area

54.608

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

-0.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with D702-0242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D702-0242?
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What is the minimum amount of D702-0242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D702-0242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D702-0242
  • 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 D702-0242 available by request