D344-9027 Screening compound: 2-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one

D344-9027 Screening compound: 2-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
D344-9027 Screening compound: 2-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D344-9027
2-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-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

D344-9027

Molecular Formula

C19H15ClN4O2S2 (C19 H15 ClN4 O2 S2)

Compound Name

2-({[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one

IUPAC name

11-({[5-(3-chlorophenyl)-134-oxadiazol-2-yl]sulfanyl}methyl)-8-thia-110-diazatricyclo[7.4.0.0^{27}]trideca-2(7)911-trien-13-one

SMILES

O=C1N(C(CCCC2)=C2S2)C2=NC(CSc2nnc(-c3cccc(Cl)c3)o2)=C1

InChI

InChI=1S/C19H15ClN4O2S2/c20-12-5-3-4-11(8-12)17-22-23-19(26-17)27-10-13-9-16(25)24-14-6-1-2-7-15(14)28-18(24)21-13/h3-5,8-9H,1-2,6-7,10H2

InChI Key

OFGALZDMKQDHMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14820885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.94

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.629

Distribution Coefficient, logD

3.629

Water Solubility, LogSw

-4.04

Polar Surface Area

56.201

Acid Dissociation Constant (pKa)

23.98

Base Dissociation Constant (pKb)

-1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D344-9027 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D344-9027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D344-9027?
Check Price and Availability of D344-9027, 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 D344-9027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D344-9027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D344-9027
  • 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 D344-9027 available by request