F509-0018 Screening compound: N-[(2-chlorophenyl)methyl]-2-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}acetamide

F509-0018 Screening compound: N-[(2-chlorophenyl)methyl]-2-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}acetamide
F509-0018 Screening compound: N-[(2-chlorophenyl)methyl]-2-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F509-0018
N-[(2-chlorophenyl)methyl]-2-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-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

F509-0018

Molecular Formula

C23H21ClN4O2 (C23 H21 ClN4 O2)

Compound Name

N-[(2-chlorophenyl)methyl]-2-{5,6-dimethyl-4-oxo-7-phenyl-3H,4H,7H-pyrrolo[2,3-d]pyrimidin-3-yl}acetamide

IUPAC name

N-[(2-chlorophenyl)methyl]-2-{56-dimethyl-4-oxo-7-phenyl-3H4H7H-pyrrolo[23-d]pyrimidin-3-yl}acetamide

SMILES

Cc(c1c2N=CN(CC(NCc(cccc3)c3Cl)=O)C1=O)c(C)n2-c1ccccc1

InChI

InChI=1S/C23H21ClN4O2/c1-15-16(2)28(18-9-4-3-5-10-18)22-21(15)23(30)27(14-26-22)13-20(29)25-12-17-8-6-7-11-19(17)24/h3-11,14H,12-13H2,1-2H3,(H,25,29)

InChI Key

WMTBSLXCHZMLQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14957411

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.617

Distribution Coefficient, logD

3.617

Water Solubility, LogSw

-4.09

Polar Surface Area

53.137

Acid Dissociation Constant (pKa)

13.42

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with F509-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F509-0018?
Check Price and Availability of F509-0018, 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 F509-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F509-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F509-0018
  • 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 F509-0018 available by request