F462-0534 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl}-N-(2,6-dimethylphenyl)acetamide

F462-0534 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl}-N-(2,6-dimethylphenyl)acetamide
F462-0534 Screening compound: 2-{3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl}-N-(2,6-dimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F462-0534
2-{3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl}-N-(2,6-dimethylphenyl)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

F462-0534

Molecular Formula

C23H20ClN5O3 (C23 H20 ClN5 O3)

Compound Name

2-{3-[(2-chlorophenyl)methyl]-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl}-N-(2,6-dimethylphenyl)acetamide

IUPAC name

2-{3-[(2-chlorophenyl)methyl]-24-dioxo-1234-tetrahydropteridin-1-yl}-N-(26-dimethylphenyl)acetamide

SMILES

Cc1cccc(C)c1NC(CN(c1c(C(N2Cc(cccc3)c3Cl)=O)nccn1)C2=O)=O

InChI

InChI=1S/C23H20ClN5O3/c1-14-6-5-7-15(2)19(14)27-18(30)13-28-21-20(25-10-11-26-21)22(31)29(23(28)32)12-16-8-3-4-9-17(16)24/h3-11H,12-13H2,1-2H3,(H,27,30)

InChI Key

MINSSSSLQQLUCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27130897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.9

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.403

Distribution Coefficient, logD

3.403

Water Solubility, LogSw

-3.49

Polar Surface Area

73.260

Acid Dissociation Constant (pKa)

12.42

Base Dissociation Constant (pKb)

0.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with F462-0534 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F462-0534?
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What is the minimum amount of F462-0534 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F462-0534
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F462-0534
  • 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 F462-0534 available by request