CM4697-2812 Screening compound: 1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-azetanyl)-3-phenyl-1-propanone

CM4697-2812 Screening compound: 1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-azetanyl)-3-phenyl-1-propanone
CM4697-2812 Screening compound: 1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-azetanyl)-3-phenyl-1-propanone alternative view

Chemical Structure Depiction of ChemDiv screening compound CM4697-2812
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-azetanyl)-3-phenyl-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

CM4697-2812

Molecular Formula

C19H24N4O (C19 H24 N4 O)

Compound Name

1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}-1-azetanyl)-3-phenyl-1-propanone

IUPAC name

n/a

SMILES

O=C(CCc1ccccc1)N1CC(Cc2nncn2CC2CC2)C1

InChI

InChI=1S/C19H24N4O/c24-19(9-8-15-4-2-1-3-5-15)22-12-17(13-22)10-18-21-20-14-23(18)11-16-6-7-16/h1-5,14,16-17H,6-13H2

InChI Key

KYBOARGANRNFQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD30467583

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.310

Distribution Coefficient, logD

2.310

Water Solubility, LogSw

-2.45

Polar Surface Area

42.141

Acid Dissociation Constant (pKa)

21.08

Base Dissociation Constant (pKb)

4.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

References: we are preparing a list of scientific research reports with CM4697-2812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound CM4697-2812?
Check Price and Availability of CM4697-2812, 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 CM4697-2812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for CM4697-2812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for CM4697-2812
  • 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 CM4697-2812 available by request