F865-0890 Screening compound: N-(4-chlorophenyl)-5-[4-({[3-(pyrrolidin-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide

F865-0890 Screening compound: N-(4-chlorophenyl)-5-[4-({[3-(pyrrolidin-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
F865-0890 Screening compound: N-(4-chlorophenyl)-5-[4-({[3-(pyrrolidin-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F865-0890
N-(4-chlorophenyl)-5-[4-({[3-(pyrrolidin-1-yl)propyl]carbamoyl}methyl)piperidine-1-carbonyl]-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

F865-0890

Molecular Formula

C24H31ClN6O3S (C24 H31 ClN6 O3 S)

Compound Name

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

IUPAC name

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

SMILES

O=C(CC(CC1)CCN1C(c1nnc(C(Nc(cc2)ccc2Cl)=O)s1)=O)NCCCN1CCCC1

InChI

InChI=1S/C24H31ClN6O3S/c25-18-4-6-19(7-5-18)27-21(33)22-28-29-23(35-22)24(34)31-14-8-17(9-15-31)16-20(32)26-10-3-13-30-11-1-2-12-30/h4-7,17H,1-3,8-16H2,(H,26,32)(H,27,33)

InChI Key

ACLZEPWURSFKKR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14969124

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

519.07

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

2.369

Distribution Coefficient, logD

-0.722

Water Solubility, LogSw

-3.33

Polar Surface Area

91.872

Acid Dissociation Constant (pKa)

8.37

Base Dissociation Constant (pKb)

10.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.20

F865-0890 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with F865-0890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F865-0890?
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What is the minimum amount of F865-0890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F865-0890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F865-0890
  • 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 F865-0890 available by request