8011-5596 Screening compound: 4-(4-hydroxy-3-methoxyphenyl)-1,3,5,6,8-pentamethyl-decahydro-[1,3]diazino[4,5-d]pyrimidine-2,7-dione

8011-5596 Screening compound: 4-(4-hydroxy-3-methoxyphenyl)-1,3,5,6,8-pentamethyl-decahydro-[1,3]diazino[4,5-d]pyrimidine-2,7-dione
8011-5596 Screening compound: 4-(4-hydroxy-3-methoxyphenyl)-1,3,5,6,8-pentamethyl-decahydro-[1,3]diazino[4,5-d]pyrimidine-2,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-5596
4-(4-hydroxy-3-methoxyphenyl)-1,3,5,6,8-pentamethyl-decahydro-[1,3]diazino[4,5-d]pyrimidine-2,7-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

8011-5596

Molecular Formula

C18H26N4O4 (C18 H26 N4 O4)

Compound Name

4-(4-hydroxy-3-methoxyphenyl)-1,3,5,6,8-pentamethyl-decahydro-[1,3]diazino[4,5-d]pyrimidine-2,7-dione

IUPAC name

n/a

SMILES

CC(C(C(c(cc1)cc(OC)c1O)N1C)C(N2C)N(C)C1=O)N(C)C2=O

InChI

InChI=1S/C18H26N4O4/c1-10-14-15(11-7-8-12(23)13(9-11)26-6)20(3)18(25)22(5)16(14)21(4)17(24)19(10)2/h7-10,14-16,23H,1-6H3

InChI Key

DBLJYIVEHBFBMD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02127400

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.597

Distribution Coefficient, logD

0.592

Water Solubility, LogSw

-1.57

Polar Surface Area

60.268

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

55.60

8011-5596 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8011-5596 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-5596?
Check Price and Availability of 8011-5596, 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 8011-5596 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-5596
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-5596
  • 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 8011-5596 available by request