D283-0090 Screening compound: 2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N-(2-methoxy-5-methylphenyl)acetamide

D283-0090 Screening compound: 2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N-(2-methoxy-5-methylphenyl)acetamide
D283-0090 Screening compound: 2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N-(2-methoxy-5-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D283-0090
2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N-(2-methoxy-5-methylphenyl)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

D283-0090

Molecular Formula

C17H19N5O4 (C17 H19 N5 O4)

Compound Name

2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)-N-(2-methoxy-5-methylphenyl)acetamide

IUPAC name

2-(13-dimethyl-26-dioxo-2369-tetrahydro-1H-purin-9-yl)-N-(2-methoxy-5-methylphenyl)acetamide

SMILES

Cc(cc1)cc(NC(Cn2c(N(C)C(N(C)C3=O)=O)c3nc2)=O)c1OC

InChI

InChI=1S/C17H19N5O4/c1-10-5-6-12(26-4)11(7-10)19-13(23)8-22-9-18-14-15(22)20(2)17(25)21(3)16(14)24/h5-7,9H,8H2,1-4H3,(H,19,23)

InChI Key

YOUVAYFFAMSOJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816724

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.939

Distribution Coefficient, logD

0.939

Water Solubility, LogSw

-2.19

Polar Surface Area

72.986

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

1.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

D283-0090 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D283-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D283-0090?
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What is the minimum amount of D283-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D283-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D283-0090
  • 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 D283-0090 available by request