F735-0879 Screening compound: 5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide

F735-0879 Screening compound: 5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
F735-0879 Screening compound: 5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F735-0879
5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}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

F735-0879

Molecular Formula

C22H31N5O2S (C22 H31 N5 O2 S)

Compound Name

5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide

IUPAC name

5-(2-methylpropyl)-N-(4-{[3-(pyrrolidin-1-yl)butyl]carbamoyl}phenyl)-134-thiadiazole-2-carboxamide

SMILES

CC(C)Cc1nnc(C(Nc(cc2)ccc2C(NCCC(C)N2CCCC2)=O)=O)s1

InChI

InChI=1S/C22H31N5O2S/c1-15(2)14-19-25-26-22(30-19)21(29)24-18-8-6-17(7-9-18)20(28)23-11-10-16(3)27-12-4-5-13-27/h6-9,15-16H,4-5,10-14H2,1-3H3,(H,23,28)(H,24,29)/t16-/m0/s1

InChI Key

KQCZGOBVFAAGQF-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14965370

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.898

Distribution Coefficient, logD

-0.497

Water Solubility, LogSw

-3.52

Polar Surface Area

75.590

Acid Dissociation Constant (pKa)

9.21

Base Dissociation Constant (pKb)

10.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

54.50

F735-0879 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with F735-0879 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F735-0879?
Check Price and Availability of F735-0879, 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 F735-0879 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F735-0879
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F735-0879
  • 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 F735-0879 available by request