F865-0625 Screening compound: 5-[4-({[3-(azepan-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide

F865-0625 Screening compound: 5-[4-({[3-(azepan-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
F865-0625 Screening compound: 5-[4-({[3-(azepan-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F865-0625
5-[4-({[3-(azepan-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide

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

F865-0625

Molecular Formula

C26H36N6O3S (C26 H36 N6 O3 S)

Compound Name

5-[4-({[3-(azepan-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-[4-({[3-(azepan-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-N-phenyl-134-thiadiazole-2-carboxamide

SMILES

O=C(CC(CC1)CCN1C(c1nnc(C(Nc2ccccc2)=O)s1)=O)NCCCN1CCCCCC1

InChI

InChI=1S/C26H36N6O3S/c33-22(27-13-8-16-31-14-6-1-2-7-15-31)19-20-11-17-32(18-12-20)26(35)25-30-29-24(36-25)23(34)28-21-9-4-3-5-10-21/h3-5,9-10,20H,1-2,6-8,11-19H2,(H,27,33)(H,28,34)

InChI Key

MVVYVRNAAYDRKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14969000

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.68

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.442

Distribution Coefficient, logD

-0.186

Water Solubility, LogSw

-2.76

Polar Surface Area

91.837

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

10.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.70

F865-0625 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F865-0625 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F865-0625?
Check Price and Availability of F865-0625, 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 F865-0625 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F865-0625
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F865-0625
  • 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 F865-0625 available by request