G517-0291 Screening compound: 2-methyl-4-(4-propoxyphenoxy)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

G517-0291 Screening compound: 2-methyl-4-(4-propoxyphenoxy)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
G517-0291 Screening compound: 2-methyl-4-(4-propoxyphenoxy)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound G517-0291
2-methyl-4-(4-propoxyphenoxy)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

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

G517-0291

Molecular Formula

C20H22N2O2S (C20 H22 N2 O2 S)

Compound Name

2-methyl-4-(4-propoxyphenoxy)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

IUPAC name

5-methyl-3-(4-propoxyphenoxy)-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraene

SMILES

CCCOc(cc1)ccc1Oc1c(c(CCCC2)c2s2)c2nc(C)n1

InChI

InChI=1S/C20H22N2O2S/c1-3-12-23-14-8-10-15(11-9-14)24-19-18-16-6-4-5-7-17(16)25-20(18)22-13(2)21-19/h8-11H,3-7,12H2,1-2H3

InChI Key

GXBPTOOXTIIXAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15015230

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.988

Distribution Coefficient, logD

5.988

Water Solubility, LogSw

-5.77

Polar Surface Area

34.371

Acid Dissociation Constant (pKa)

25.24

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

G517-0291 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G517-0291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G517-0291?
Check Price and Availability of G517-0291, 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 G517-0291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G517-0291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G517-0291
  • 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 G517-0291 available by request