D509-0605 Screening compound: N-(3,4-dimethylphenyl)-2-({6-[2-(2-methylpropanamido)phenyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)propanamide

D509-0605 Screening compound: N-(3,4-dimethylphenyl)-2-({6-[2-(2-methylpropanamido)phenyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)propanamide
D509-0605 Screening compound: N-(3,4-dimethylphenyl)-2-({6-[2-(2-methylpropanamido)phenyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D509-0605
N-(3,4-dimethylphenyl)-2-({6-[2-(2-methylpropanamido)phenyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)propanamide

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

D509-0605

Molecular Formula

C24H27N5O3S (C24 H27 N5 O3 S)

Compound Name

N-(3,4-dimethylphenyl)-2-({6-[2-(2-methylpropanamido)phenyl]-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)propanamide

IUPAC name

N-(34-dimethylphenyl)-2-({6-[2-(2-methylpropanamido)phenyl]-5-oxo-45-dihydro-124-triazin-3-yl}sulfanyl)propanamide

SMILES

CC(C)C(Nc(cccc1)c1C(C(N1)=O)=NN=C1SC(C)C(Nc1cc(C)c(C)cc1)=O)=O

InChI

InChI=1S/C24H27N5O3S/c1-13(2)21(30)26-19-9-7-6-8-18(19)20-23(32)27-24(29-28-20)33-16(5)22(31)25-17-11-10-14(3)15(4)12-17/h6-13,16H,1-5H3,(H,25,31)(H,26,30)(H,27,29,32)/t16-/m0/s1

InChI Key

GZLSJTMDNFLGHR-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27590036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.763

Distribution Coefficient, logD

4.701

Water Solubility, LogSw

-4.47

Polar Surface Area

90.823

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

1.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with D509-0605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D509-0605?
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What is the minimum amount of D509-0605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D509-0605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D509-0605
  • 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 D509-0605 available by request