F235-1097 Screening compound: 4-isopropoxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

F235-1097 Screening compound: 4-isopropoxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
F235-1097 Screening compound: 4-isopropoxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F235-1097
4-isopropoxy-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

F235-1097

Molecular Formula

C13H16N2OS (C13 H16 N2 OS)

Compound Name

4-isopropoxy-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

IUPAC name

3-(propan-2-yloxy)-8-thia-46-diazatricyclo[7.4.0.0^{27}]trideca-1(9)246-tetraene

SMILES

CC(C)Oc1c(c(CCCC2)c2s2)c2ncn1

InChI

InChI=1S/C13H16N2OS/c1-8(2)16-12-11-9-5-3-4-6-10(9)17-13(11)15-7-14-12/h7-8H,3-6H2,1-2H3

InChI Key

PBGJMNUYXJQGRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01646595

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.985

Distribution Coefficient, logD

3.985

Water Solubility, LogSw

-4.20

Polar Surface Area

28.634

Acid Dissociation Constant (pKa)

22.64

Base Dissociation Constant (pKb)

2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

F235-1097 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with F235-1097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F235-1097?
Check Price and Availability of F235-1097, 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 F235-1097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F235-1097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F235-1097
  • 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 F235-1097 available by request