8008-3575 Screening compound: 4-[5-phenyl-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine

8008-3575 Screening compound: 4-[5-phenyl-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine
8008-3575 Screening compound: 4-[5-phenyl-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-3575
4-[5-phenyl-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine

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

8008-3575

Molecular Formula

C15H15N7O2 (C15 H15 N7 O2)

Compound Name

4-[5-phenyl-4-(pyrrolidine-1-carbonyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine

IUPAC name

4-[5-phenyl-4-(pyrrolidine-1-carbonyl)-1H-123-triazol-1-yl]-125-oxadiazol-3-amine

SMILES

Nc1nonc1-n1nnc(C(N2CCCC2)=O)c1-c1ccccc1

InChI

InChI=1S/C15H15N7O2/c16-13-14(19-24-18-13)22-12(10-6-2-1-3-7-10)11(17-20-22)15(23)21-8-4-5-9-21/h1-3,6-7H,4-5,8-9H2,(H2,16,18)

InChI Key

WHGASVZQTJYVSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01306058

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.603

Distribution Coefficient, logD

1.603

Water Solubility, LogSw

-1.75

Polar Surface Area

99.101

Acid Dissociation Constant (pKa)

16.18

Base Dissociation Constant (pKb)

-1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

8008-3575 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8008-3575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-3575?
Check Price and Availability of 8008-3575, 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 8008-3575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-3575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-3575
  • 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 8008-3575 available by request