T816-0138 Screening compound: 7-[2-(2-methoxyphenoxy)ethyl]-2,4-dimethyl-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-one

T816-0138 Screening compound: 7-[2-(2-methoxyphenoxy)ethyl]-2,4-dimethyl-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-one
T816-0138 Screening compound: 7-[2-(2-methoxyphenoxy)ethyl]-2,4-dimethyl-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T816-0138
7-[2-(2-methoxyphenoxy)ethyl]-2,4-dimethyl-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-one

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

T816-0138

Molecular Formula

C17H19N3O3 (C17 H19 N3 O3)

Compound Name

7-[2-(2-methoxyphenoxy)ethyl]-2,4-dimethyl-5H,6H,7H-pyrrolo[2,3-d]pyrimidin-6-one

IUPAC name

7-[2-(2-methoxyphenoxy)ethyl]-24-dimethyl-5H6H7H-pyrrolo[23-d]pyrimidin-6-one

SMILES

Cc1nc(C)nc(N2CCOc(cccc3)c3OC)c1CC2=O

InChI

InChI=1S/C17H19N3O3/c1-11-13-10-16(21)20(17(13)19-12(2)18-11)8-9-23-15-7-5-4-6-14(15)22-3/h4-7H,8-10H2,1-3H3

InChI Key

DYJNXYPWBRPDKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623740

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.179

Distribution Coefficient, logD

-0.141

Water Solubility, LogSw

-2.27

Polar Surface Area

51.142

Acid Dissociation Constant (pKa)

5.08

Base Dissociation Constant (pKb)

2.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

T816-0138 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with T816-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T816-0138?
Check Price and Availability of T816-0138, 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 T816-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T816-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T816-0138
  • 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 T816-0138 available by request