C794-1065 Screening compound: 4-{5-methyl-8-oxo-7H,8H-imidazo[1,2-d][1,2,4]triazin-7-yl}-N-(1-phenylethyl)butanamide

C794-1065 Screening compound: 4-{5-methyl-8-oxo-7H,8H-imidazo[1,2-d][1,2,4]triazin-7-yl}-N-(1-phenylethyl)butanamide
C794-1065 Screening compound: 4-{5-methyl-8-oxo-7H,8H-imidazo[1,2-d][1,2,4]triazin-7-yl}-N-(1-phenylethyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C794-1065
4-{5-methyl-8-oxo-7H,8H-imidazo[1,2-d][1,2,4]triazin-7-yl}-N-(1-phenylethyl)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

C794-1065

Molecular Formula

C18H21N5O2 (C18 H21 N5 O2)

Compound Name

4-{5-methyl-8-oxo-7H,8H-imidazo[1,2-d][1,2,4]triazin-7-yl}-N-(1-phenylethyl)butanamide

IUPAC name

4-{5-methyl-8-oxo-7H8H-imidazo[12-d][124]triazin-7-yl}-N-(1-phenylethyl)butanamide

SMILES

CC(c1ccccc1)NC(CCCN(C1=O)N=C(C)n2c1ncc2)=O

InChI

InChI=1S/C18H21N5O2/c1-13(15-7-4-3-5-8-15)20-16(24)9-6-11-23-18(25)17-19-10-12-22(17)14(2)21-23/h3-5,7-8,10,12-13H,6,9,11H2,1-2H3,(H,20,24)/t13-/m0/s1

InChI Key

KVPQPIJDCDYTIX-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD14796343

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.701

Distribution Coefficient, logD

0.685

Water Solubility, LogSw

-1.68

Polar Surface Area

63.923

Acid Dissociation Constant (pKa)

12.99

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C794-1065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C794-1065?
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What is the minimum amount of C794-1065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C794-1065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C794-1065
  • 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 C794-1065 available by request