D306-0090 Screening compound: N-(2,4-dimethylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide

D306-0090 Screening compound: N-(2,4-dimethylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide
D306-0090 Screening compound: N-(2,4-dimethylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D306-0090
N-(2,4-dimethylphenyl)-2-[(2,6-dimethylpyrimidin-4-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

D306-0090

Molecular Formula

C16H19N3OS (C16 H19 N3 OS)

Compound Name

N-(2,4-dimethylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)sulfanyl]acetamide

IUPAC name

N-(24-dimethylphenyl)-2-[(26-dimethylpyrimidin-4-yl)sulfanyl]acetamide

SMILES

Cc(cc1)cc(C)c1NC(CSc1nc(C)nc(C)c1)=O

InChI

InChI=1S/C16H19N3OS/c1-10-5-6-14(11(2)7-10)19-15(20)9-21-16-8-12(3)17-13(4)18-16/h5-8H,9H2,1-4H3,(H,19,20)

InChI Key

BSXNMKLVRHBYKU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10480120

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.950

Distribution Coefficient, logD

2.949

Water Solubility, LogSw

-3.02

Polar Surface Area

39.770

Acid Dissociation Constant (pKa)

12.39

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

D306-0090 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with D306-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D306-0090?
Check Price and Availability of D306-0090, 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 D306-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D306-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D306-0090
  • 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 D306-0090 available by request