D090-0135 Screening compound: 3-[3-(dimethylamino)propyl]-7-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

D090-0135 Screening compound: 3-[3-(dimethylamino)propyl]-7-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
D090-0135 Screening compound: 3-[3-(dimethylamino)propyl]-7-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound D090-0135
3-[3-(dimethylamino)propyl]-7-methyl-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

D090-0135

Molecular Formula

C11H17N5O2 (C11 H17 N5 O2)

Compound Name

3-[3-(dimethylamino)propyl]-7-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

IUPAC name

3-[3-(dimethylamino)propyl]-7-methyl-2367-tetrahydro-1H-purine-26-dione

SMILES

CN(C)CCCN(c1c(C(N2)=O)n(C)cn1)C2=O

InChI

InChI=1S/C11H17N5O2/c1-14(2)5-4-6-16-9-8(15(3)7-12-9)10(17)13-11(16)18/h7H,4-6H2,1-3H3,(H,13,17,18)

InChI Key

UWAWDYXFCRTDJK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02924900

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

251.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.280

Distribution Coefficient, logD

-2.054

Water Solubility, LogSw

-1.49

Polar Surface Area

56.780

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

9.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

D090-0135 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D090-0135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D090-0135?
Check Price and Availability of D090-0135, 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 D090-0135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D090-0135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D090-0135
  • 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 D090-0135 available by request