P935-1606 Screening compound: 1-{2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidino}-3-(3,5-dimethyl-4-isoxazolyl)-1-propanone

P935-1606 Screening compound: 1-{2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidino}-3-(3,5-dimethyl-4-isoxazolyl)-1-propanone
P935-1606 Screening compound: 1-{2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidino}-3-(3,5-dimethyl-4-isoxazolyl)-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound P935-1606
1-{2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidino}-3-(3,5-dimethyl-4-isoxazolyl)-1-propanone

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

P935-1606

Molecular Formula

C19H27N5O2 (C19 H27 N5 O2)

Compound Name

1-{2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]piperidino}-3-(3,5-dimethyl-4-isoxazolyl)-1-propanone

IUPAC name

n/a

SMILES

Cc1noc(C)c1CCC(N(CCCC1)C1c1nncn1CC1CC1)=O

InChI

InChI=1S/C19H27N5O2/c1-13-16(14(2)26-22-13)8-9-18(25)24-10-4-3-5-17(24)19-21-20-12-23(19)11-15-6-7-15/h12,15,17H,3-11H2,1-2H3/t17-/m0/s1

InChI Key

RXCGLDIETRDSTG-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD29031581

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.713

Distribution Coefficient, logD

1.713

Water Solubility, LogSw

-1.63

Polar Surface Area

62.699

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.40

P935-1606 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Targets:
  • GPCR
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P935-1606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P935-1606?
Check Price and Availability of P935-1606, 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 P935-1606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P935-1606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P935-1606
  • 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 P935-1606 available by request