8009-2411 Screening compound: 2,4-bis(isopropylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine

8009-2411 Screening compound: 2,4-bis(isopropylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
8009-2411 Screening compound: 2,4-bis(isopropylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-2411
2,4-bis(isopropylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[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

8009-2411

Molecular Formula

C17H24N2OS3 (C17 H24 N2 OS3)

Compound Name

2,4-bis(isopropylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine

IUPAC name

1212-dimethyl-35-bis(propan-2-ylsulfanyl)-11-oxa-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)35-tetraene

SMILES

CC(C)Sc1c(c(CC(C)(C)OC2)c2s2)c2nc(SC(C)C)n1

InChI

InChI=1S/C17H24N2OS3/c1-9(2)21-14-13-11-7-17(5,6)20-8-12(11)23-15(13)19-16(18-14)22-10(3)4/h9-10H,7-8H2,1-6H3

InChI Key

NKJTULGBFXYAKV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01089788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.308

Distribution Coefficient, logD

6.308

Water Solubility, LogSw

-5.84

Polar Surface Area

26.385

Acid Dissociation Constant (pKa)

21.17

Base Dissociation Constant (pKb)

2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.70

8009-2411 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8009-2411 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-2411?
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What is the minimum amount of 8009-2411 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-2411
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-2411
  • 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 8009-2411 available by request