D353-0406 Screening compound: 2-methyl-5-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one

D353-0406 Screening compound: 2-methyl-5-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one
D353-0406 Screening compound: 2-methyl-5-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D353-0406
2-methyl-5-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-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

D353-0406

Molecular Formula

C19H18N4O6S (C19 H18 N4 O6 S)

Compound Name

2-methyl-5-({[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-7H-[1,2]oxazolo[2,3-a]pyrimidin-7-one

IUPAC name

2-methyl-5-({[5-(345-trimethoxyphenyl)-134-oxadiazol-2-yl]sulfanyl}methyl)-7H-[12]oxazolo[23-a]pyrimidin-7-one

SMILES

CC(ON12)=CC2=NC(CSc2nnc(-c(cc3OC)cc(OC)c3OC)o2)=CC1=O

InChI

InChI=1S/C19H18N4O6S/c1-10-5-15-20-12(8-16(24)23(15)29-10)9-30-19-22-21-18(28-19)11-6-13(25-2)17(27-4)14(7-11)26-3/h5-8H,9H2,1-4H3

InChI Key

IBQLVHKTHPOCND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27581418

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.44

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.330

Distribution Coefficient, logD

1.330

Water Solubility, LogSw

-1.89

Polar Surface Area

91.506

Acid Dissociation Constant (pKa)

23.98

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D353-0406 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with D353-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D353-0406?
Check Price and Availability of D353-0406, 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 D353-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D353-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D353-0406
  • 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 D353-0406 available by request