S637-2582 Screening compound: N-{3-cyclopropyl-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-7-yl}-1,3-oxazole-5-carboxamide

S637-2582 Screening compound: N-{3-cyclopropyl-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-7-yl}-1,3-oxazole-5-carboxamide
S637-2582 Screening compound: N-{3-cyclopropyl-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-7-yl}-1,3-oxazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S637-2582
N-{3-cyclopropyl-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-7-yl}-1,3-oxazole-5-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

S637-2582

Molecular Formula

C14H17N5O2 (C14 H17 N5 O2)

Compound Name

N-{3-cyclopropyl-5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-7-yl}-1,3-oxazole-5-carboxamide

IUPAC name

n/a

SMILES

O=C(c1cnco1)NC1CCn2c(C3CC3)nnc2CC1

InChI

InChI=1S/C14H17N5O2/c20-14(11-7-15-8-21-11)16-10-3-4-12-17-18-13(9-1-2-9)19(12)6-5-10/h7-10H,1-6H2,(H,16,20)/t10-/m0/s1

InChI Key

ARTYPBSFRWLWQS-JTQLQIEISA-N

MDL Number (MFCD)

MFCD29017470

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.383

Distribution Coefficient, logD

0.227

Water Solubility, LogSw

-0.98

Polar Surface Area

68.307

Acid Dissociation Constant (pKa)

14.11

Base Dissociation Constant (pKb)

7.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.10

S637-2582 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

CNS MPO Library (28609 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
  • Nervous system
Targets:
  • Others
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S637-2582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S637-2582?
Check Price and Availability of S637-2582, 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 S637-2582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S637-2582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S637-2582
  • 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 S637-2582 available by request