3261-0718 Screening compound: 4-methyl-N-[3-(morpholine-4-carbonyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]benzamide

3261-0718 Screening compound: 4-methyl-N-[3-(morpholine-4-carbonyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]benzamide
3261-0718 Screening compound: 4-methyl-N-[3-(morpholine-4-carbonyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3261-0718
4-methyl-N-[3-(morpholine-4-carbonyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]benzamide

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

3261-0718

Molecular Formula

C22H26N2O3S (C22 H26 N2 O3 S)

Compound Name

4-methyl-N-[3-(morpholine-4-carbonyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]benzamide

IUPAC name

4-methyl-N-[3-(morpholine-4-carbonyl)-4H5H6H7H8H-cyclohepta[b]thiophen-2-yl]benzamide

SMILES

Cc(cc1)ccc1C(Nc1c(C(N2CCOCC2)=O)c(CCCCC2)c2s1)=O

InChI

InChI=1S/C22H26N2O3S/c1-15-7-9-16(10-8-15)20(25)23-21-19(22(26)24-11-13-27-14-12-24)17-5-3-2-4-6-18(17)28-21/h7-10H,2-6,11-14H2,1H3,(H,23,25)

InChI Key

UFSYLTOAQUXZAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01821725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.951

Distribution Coefficient, logD

1.210

Water Solubility, LogSw

-4.20

Polar Surface Area

47.932

Acid Dissociation Constant (pKa)

4.66

Base Dissociation Constant (pKb)

-3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

3261-0718 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3261-0718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3261-0718?
Check Price and Availability of 3261-0718, 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 3261-0718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3261-0718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3261-0718
  • 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 3261-0718 available by request