D283-0029 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yloxy)ethyl]-2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)acetamide

D283-0029 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yloxy)ethyl]-2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)acetamide
D283-0029 Screening compound: N-[2-(2H-1,3-benzodioxol-5-yloxy)ethyl]-2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D283-0029
N-[2-(2H-1,3-benzodioxol-5-yloxy)ethyl]-2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-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

D283-0029

Molecular Formula

C18H19N5O6 (C18 H19 N5 O6)

Compound Name

N-[2-(2H-1,3-benzodioxol-5-yloxy)ethyl]-2-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-9-yl)acetamide

IUPAC name

N-[2-(2H-13-benzodioxol-5-yloxy)ethyl]-2-(13-dimethyl-26-dioxo-2369-tetrahydro-1H-purin-9-yl)acetamide

SMILES

CN(c1c(C(N2C)=O)ncn1CC(NCCOc(cc1)cc3c1OCO3)=O)C2=O

InChI

InChI=1S/C18H19N5O6/c1-21-16-15(17(25)22(2)18(21)26)20-9-23(16)8-14(24)19-5-6-27-11-3-4-12-13(7-11)29-10-28-12/h3-4,7,9H,5-6,8,10H2,1-2H3,(H,19,24)

InChI Key

NLUNYKOIDQEPOL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.38

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.649

Distribution Coefficient, logD

0.649

Water Solubility, LogSw

-2.04

Polar Surface Area

91.750

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with D283-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D283-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D283-0029
  • 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 D283-0029 available by request