K784-2103 Screening compound: 2-([1]benzothieno[3,2-d]pyrimidin-4-ylsulfanyl)-N~1~-cyclohexylacetamide

K784-2103 Screening compound: 2-([1]benzothieno[3,2-d]pyrimidin-4-ylsulfanyl)-N~1~-cyclohexylacetamide
K784-2103 Screening compound: 2-([1]benzothieno[3,2-d]pyrimidin-4-ylsulfanyl)-N~1~-cyclohexylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-2103
2-([1]benzothieno[3,2-d]pyrimidin-4-ylsulfanyl)-N~1~-cyclohexylacetamide

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

K784-2103

Molecular Formula

C18H19N3OS2 (C18 H19 N3 OS2)

Compound Name

2-([1]benzothieno[3,2-d]pyrimidin-4-ylsulfanyl)-N~1~-cyclohexylacetamide

IUPAC name

N-cyclohexyl-2-{8-thia-35-diazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-ylsulfanyl}acetamide

SMILES

O=C(CSc1c2sc(cccc3)c3c2ncn1)NC1CCCCC1

InChI

InChI=1S/C18H19N3OS2/c22-15(21-12-6-2-1-3-7-12)10-23-18-17-16(19-11-20-18)13-8-4-5-9-14(13)24-17/h4-5,8-9,11-12H,1-3,6-7,10H2,(H,21,22)

InChI Key

HRPYYQJHWMRQOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05030306

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.353

Distribution Coefficient, logD

4.353

Water Solubility, LogSw

-4.29

Polar Surface Area

45.337

Acid Dissociation Constant (pKa)

15.71

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

K784-2103 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Human Proteases Annotated Library (2868 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with K784-2103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-2103?
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What is the minimum amount of K784-2103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-2103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-2103
  • 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 K784-2103 available by request