D583-2370 Screening compound: 2-({4-ethyl-5-[(N-phenylmethanesulfonamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide

D583-2370 Screening compound: 2-({4-ethyl-5-[(N-phenylmethanesulfonamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
D583-2370 Screening compound: 2-({4-ethyl-5-[(N-phenylmethanesulfonamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D583-2370
2-({4-ethyl-5-[(N-phenylmethanesulfonamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)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

D583-2370

Molecular Formula

C23H29N5O3S2 (C23 H29 N5 O3 S2)

Compound Name

2-({4-ethyl-5-[(N-phenylmethanesulfonamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide

IUPAC name

2-({4-ethyl-5-[(N-phenylmethanesulfonamido)methyl]-4H-124-triazol-3-yl}sulfanyl)-N-(246-trimethylphenyl)acetamide

SMILES

CCn1c(SCC(Nc2c(C)cc(C)cc2C)=O)nnc1CN(c1ccccc1)S(C)(=O)=O

InChI

InChI=1S/C23H29N5O3S2/c1-6-27-20(14-28(33(5,30)31)19-10-8-7-9-11-19)25-26-23(27)32-15-21(29)24-22-17(3)12-16(2)13-18(22)4/h7-13H,6,14-15H2,1-5H3,(H,24,29)

InChI Key

YPTBKXBKTIOTSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.958

Distribution Coefficient, logD

2.958

Water Solubility, LogSw

-3.16

Polar Surface Area

78.285

Acid Dissociation Constant (pKa)

12.20

Base Dissociation Constant (pKb)

2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

References: we are preparing a list of scientific research reports with D583-2370 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D583-2370?
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What is the minimum amount of D583-2370 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D583-2370
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D583-2370
  • 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 D583-2370 available by request