D702-0676 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}-N-(3,5-difluorophenyl)acetamide

D702-0676 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}-N-(3,5-difluorophenyl)acetamide
D702-0676 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}-N-(3,5-difluorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D702-0676
2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}-N-(3,5-difluorophenyl)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

D702-0676

Molecular Formula

C19H14ClF2N3O3 (C19 H14 ClF2 N3 O3)

Compound Name

2-{3-[(2-chlorophenyl)methyl]-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-1-yl}-N-(3,5-difluorophenyl)acetamide

IUPAC name

2-{3-[(2-chlorophenyl)methyl]-26-dioxo-1236-tetrahydropyrimidin-1-yl}-N-(35-difluorophenyl)acetamide

SMILES

O=C(CN(C(C=CN1Cc(cccc2)c2Cl)=O)C1=O)Nc1cc(F)cc(F)c1

InChI

InChI=1S/C19H14ClF2N3O3/c20-16-4-2-1-3-12(16)10-24-6-5-18(27)25(19(24)28)11-17(26)23-15-8-13(21)7-14(22)9-15/h1-9H,10-11H2,(H,23,26)

InChI Key

AUKSTEVEWYARHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596940

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.79

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

3.240

Distribution Coefficient, logD

3.235

Water Solubility, LogSw

-3.45

Polar Surface Area

55.306

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with D702-0676 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D702-0676?
Check Price and Availability of D702-0676, 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 D702-0676 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D702-0676
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D702-0676
  • 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 D702-0676 available by request