S565-1484 Screening compound: 4-(cyclopropylmethyl)-3-{5-[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl}-4H-1,2,4-triazole

S565-1484 Screening compound: 4-(cyclopropylmethyl)-3-{5-[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl}-4H-1,2,4-triazole
S565-1484 Screening compound: 4-(cyclopropylmethyl)-3-{5-[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl}-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound S565-1484
4-(cyclopropylmethyl)-3-{5-[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl}-4H-1,2,4-triazole

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

S565-1484

Molecular Formula

C24H29N9O2 (C24 H29 N9 O2)

Compound Name

4-(cyclopropylmethyl)-3-{5-[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl}-4H-1,2,4-triazole

IUPAC name

4-(cyclopropylmethyl)-3-{5-[5-(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)-12-oxazole-3-carbonyl]-1-methyl-1H4H5H6H7H-pyrazolo[43-c]pyridin-3-yl}-4H-124-triazole

SMILES

CCn1nc(C)c(-c2cc(C(N(CC3)Cc4c3n(C)nc4-c3nncn3CC3CC3)=O)no2)c1C

InChI

InChI=1S/C24H29N9O2/c1-5-33-15(3)21(14(2)27-33)20-10-18(29-35-20)24(34)31-9-8-19-17(12-31)22(28-30(19)4)23-26-25-13-32(23)11-16-6-7-16/h10,13,16H,5-9,11-12H2,1-4H3

InChI Key

YGNILXRNCUGPDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31960756

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.824

Distribution Coefficient, logD

0.823

Water Solubility, LogSw

-1.10

Polar Surface Area

91.988

Acid Dissociation Constant (pKa)

19.85

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

S565-1484 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

MCL1 Targeted Library (12200 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with S565-1484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S565-1484?
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What is the minimum amount of S565-1484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S565-1484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S565-1484
  • 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 S565-1484 available by request