K784-9030 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide

K784-9030 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide
K784-9030 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-9030
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide

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

K784-9030

Molecular Formula

C27H31N5O3S (C27 H31 N5 O3 S)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5,7-dimethyl-6-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)acetamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-({57-dimethyl-6-[(3-methylphenyl)methyl]-[124]triazolo[15-a]pyrimidin-2-yl}sulfanyl)acetamide

SMILES

Cc1cccc(Cc(c(C)nc2n3)c(C)n2nc3SCC(NCCc(cc2)cc(OC)c2OC)=O)c1

InChI

InChI=1S/C27H31N5O3S/c1-17-7-6-8-21(13-17)14-22-18(2)29-26-30-27(31-32(26)19(22)3)36-16-25(33)28-12-11-20-9-10-23(34-4)24(15-20)35-5/h6-10,13,15H,11-12,14,16H2,1-5H3,(H,28,33)

InChI Key

SSVANUSDHJUNHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15099300

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

505.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.712

Distribution Coefficient, logD

3.712

Water Solubility, LogSw

-4.10

Polar Surface Area

69.129

Acid Dissociation Constant (pKa)

14.66

Base Dissociation Constant (pKb)

3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with K784-9030 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of K784-9030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-9030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-9030
  • 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 K784-9030 available by request