M715-0609 Screening compound: 1-{4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzoyl}azepane

M715-0609 Screening compound: 1-{4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzoyl}azepane
M715-0609 Screening compound: 1-{4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzoyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound M715-0609
1-{4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzoyl}azepane

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

M715-0609

Molecular Formula

C22H27N3OS (C22 H27 N3 OS)

Compound Name

1-{4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzoyl}azepane

IUPAC name

1-{4-[6-(thiomorpholin-4-yl)pyridin-3-yl]benzoyl}azepane

SMILES

O=C(c(cc1)ccc1-c(cc1)cnc1N1CCSCC1)N1CCCCCC1

InChI

InChI=1S/C22H27N3OS/c26-22(25-11-3-1-2-4-12-25)19-7-5-18(6-8-19)20-9-10-21(23-17-20)24-13-15-27-16-14-24/h5-10,17H,1-4,11-16H2

InChI Key

TXHFQTCEOYCNCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29019242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.435

Distribution Coefficient, logD

4.399

Water Solubility, LogSw

-4.24

Polar Surface Area

29.000

Acid Dissociation Constant (pKa)

24.57

Base Dissociation Constant (pKb)

6.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

M715-0609 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with M715-0609 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M715-0609?
Check Price and Availability of M715-0609, 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 M715-0609 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M715-0609
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M715-0609
  • 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 M715-0609 available by request