7882-1303F Screening compound: 4-phenyl-N-(4H-1,2,4-triazol-3-yl)butanamide

7882-1303F Screening compound: 4-phenyl-N-(4H-1,2,4-triazol-3-yl)butanamide
7882-1303F Screening compound: 4-phenyl-N-(4H-1,2,4-triazol-3-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7882-1303F
4-phenyl-N-(4H-1,2,4-triazol-3-yl)butanamide

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

7882-1303F

Molecular Formula

C12H14N4O (C12 H14 N4 O)

Compound Name

4-phenyl-N-(4H-1,2,4-triazol-3-yl)butanamide

IUPAC name

4-phenyl-N-(4H-124-triazol-3-yl)butanamide

SMILES

O=C(CCCc1ccccc1)Nc1nnc[nH]1

InChI

InChI=1S/C12H14N4O/c17-11(15-12-13-9-14-16-12)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H2,13,14,15,16,17)

InChI Key

YHOMLBKWRKVVNM-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

230.27

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.978

Distribution Coefficient, logD

0.951

Water Solubility, LogSw

-1.78

Polar Surface Area

59.954

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 7882-1303F chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7882-1303F?
Check Price and Availability of 7882-1303F, 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 7882-1303F you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7882-1303F
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7882-1303F
  • 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 7882-1303F available by request