D306-0138 Screening compound: N-(2-ethyl-6-methylphenyl)-2-[(6-phenylpyrimidin-4-yl)sulfanyl]propanamide

D306-0138 Screening compound: N-(2-ethyl-6-methylphenyl)-2-[(6-phenylpyrimidin-4-yl)sulfanyl]propanamide
D306-0138 Screening compound: N-(2-ethyl-6-methylphenyl)-2-[(6-phenylpyrimidin-4-yl)sulfanyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D306-0138
N-(2-ethyl-6-methylphenyl)-2-[(6-phenylpyrimidin-4-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

D306-0138

Molecular Formula

C22H23N3OS (C22 H23 N3 OS)

Compound Name

N-(2-ethyl-6-methylphenyl)-2-[(6-phenylpyrimidin-4-yl)sulfanyl]propanamide

IUPAC name

N-(2-ethyl-6-methylphenyl)-2-[(6-phenylpyrimidin-4-yl)sulfanyl]propanamide

SMILES

CCc(cccc1C)c1NC(C(C)Sc1ncnc(-c2ccccc2)c1)=O

InChI

InChI=1S/C22H23N3OS/c1-4-17-12-8-9-15(2)21(17)25-22(26)16(3)27-20-13-19(23-14-24-20)18-10-6-5-7-11-18/h5-14,16H,4H2,1-3H3,(H,25,26)/t16-/m0/s1

InChI Key

QCRVFFXBQWAQBI-INIZCTEOSA-N

MDL Number (MFCD)

MFCD10480130

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.413

Distribution Coefficient, logD

5.413

Water Solubility, LogSw

-5.35

Polar Surface Area

40.833

Acid Dissociation Constant (pKa)

12.46

Base Dissociation Constant (pKb)

2.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

D306-0138 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with D306-0138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D306-0138?
Check Price and Availability of D306-0138, 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 D306-0138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D306-0138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D306-0138
  • 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 D306-0138 available by request