4787-1820 Screening compound: 8-{[2-(diethylamino)ethyl]amino}-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

4787-1820 Screening compound: 8-{[2-(diethylamino)ethyl]amino}-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
4787-1820 Screening compound: 8-{[2-(diethylamino)ethyl]amino}-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 4787-1820
8-{[2-(diethylamino)ethyl]amino}-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

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

4787-1820

Molecular Formula

C14H24N6O2 (C14 H24 N6 O2)

Compound Name

8-{[2-(diethylamino)ethyl]amino}-1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

8-{[2-(diethylamino)ethyl]amino}-137-trimethyl-2367-tetrahydro-1H-purine-26-dione

SMILES

CCN(CC)CCNc1nc(N(C)C(N(C)C2=O)=O)c2n1C

InChI

InChI=1S/C14H24N6O2/c1-6-20(7-2)9-8-15-13-16-11-10(17(13)3)12(21)19(5)14(22)18(11)4/h6-9H2,1-5H3,(H,15,16)

InChI Key

YULCFIQJHSAXCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03032409

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.239

Distribution Coefficient, logD

-1.836

Water Solubility, LogSw

-1.34

Polar Surface Area

59.452

Acid Dissociation Constant (pKa)

18.10

Base Dissociation Constant (pKb)

10.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.30

4787-1820 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4787-1820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4787-1820?
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What is the minimum amount of 4787-1820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4787-1820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4787-1820
  • 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 4787-1820 available by request