F462-0060 Screening compound: 2-(3-benzyl-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl)-N-(5-chloro-2-methoxyphenyl)acetamide

F462-0060 Screening compound: 2-(3-benzyl-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl)-N-(5-chloro-2-methoxyphenyl)acetamide
F462-0060 Screening compound: 2-(3-benzyl-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl)-N-(5-chloro-2-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F462-0060
2-(3-benzyl-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl)-N-(5-chloro-2-methoxyphenyl)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

F462-0060

Molecular Formula

C22H18ClN5O4 (C22 H18 ClN5 O4)

Compound Name

2-(3-benzyl-2,4-dioxo-1,2,3,4-tetrahydropteridin-1-yl)-N-(5-chloro-2-methoxyphenyl)acetamide

IUPAC name

2-(3-benzyl-24-dioxo-1234-tetrahydropteridin-1-yl)-N-(5-chloro-2-methoxyphenyl)acetamide

SMILES

COc(ccc(Cl)c1)c1NC(CN(c1nccnc1C(N1Cc2ccccc2)=O)C1=O)=O

InChI

InChI=1S/C22H18ClN5O4/c1-32-17-8-7-15(23)11-16(17)26-18(29)13-27-20-19(24-9-10-25-20)21(30)28(22(27)31)12-14-5-3-2-4-6-14/h2-11H,12-13H2,1H3,(H,26,29)

InChI Key

WRAHTNKEMQDHRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27130798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.87

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.987

Distribution Coefficient, logD

2.984

Water Solubility, LogSw

-3.37

Polar Surface Area

81.589

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with F462-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F462-0060?
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What is the minimum amount of F462-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F462-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F462-0060
  • 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 F462-0060 available by request