8014-3095 Screening compound: 2,4-dimethyl-3-(1H-1,2,3,4-tetraazol-1-yl)phenyl morpholino sulfone

8014-3095 Screening compound: 2,4-dimethyl-3-(1H-1,2,3,4-tetraazol-1-yl)phenyl morpholino sulfone
8014-3095 Screening compound: 2,4-dimethyl-3-(1H-1,2,3,4-tetraazol-1-yl)phenyl morpholino sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-3095
2,4-dimethyl-3-(1H-1,2,3,4-tetraazol-1-yl)phenyl morpholino sulfone

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

8014-3095

Molecular Formula

C13H17N5O3S (C13 H17 N5 O3 S)

Compound Name

2,4-dimethyl-3-(1H-1,2,3,4-tetraazol-1-yl)phenyl morpholino sulfone

IUPAC name

4-[24-dimethyl-3-(1H-1234-tetrazol-1-yl)benzenesulfonyl]morpholine

SMILES

Cc(ccc(S(N1CCOCC1)(=O)=O)c1C)c1-n1nnnc1

InChI

InChI=1S/C13H17N5O3S/c1-10-3-4-12(11(2)13(10)18-9-14-15-16-18)22(19,20)17-5-7-21-8-6-17/h3-4,9H,5-8H2,1-2H3

InChI Key

XKOJBOADBFAPHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03368457

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.305

Distribution Coefficient, logD

1.305

Water Solubility, LogSw

-2.26

Polar Surface Area

79.021

Acid Dissociation Constant (pKa)

24.10

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

8014-3095 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8014-3095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-3095?
Check Price and Availability of 8014-3095, 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 8014-3095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-3095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-3095
  • 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 8014-3095 available by request