D276-0041 Screening compound: 2-{[(benzylcarbamoyl)methyl]sulfanyl}-4,6-dimethyl-N-phenylpyridine-3-carboxamide

D276-0041 Screening compound: 2-{[(benzylcarbamoyl)methyl]sulfanyl}-4,6-dimethyl-N-phenylpyridine-3-carboxamide
D276-0041 Screening compound: 2-{[(benzylcarbamoyl)methyl]sulfanyl}-4,6-dimethyl-N-phenylpyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D276-0041
2-{[(benzylcarbamoyl)methyl]sulfanyl}-4,6-dimethyl-N-phenylpyridine-3-carboxamide

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

D276-0041

Molecular Formula

C23H23N3O2S (C23 H23 N3 O2 S)

Compound Name

2-{[(benzylcarbamoyl)methyl]sulfanyl}-4,6-dimethyl-N-phenylpyridine-3-carboxamide

IUPAC name

2-{[(benzylcarbamoyl)methyl]sulfanyl}-46-dimethyl-N-phenylpyridine-3-carboxamide

SMILES

Cc1c(C(Nc2ccccc2)=O)c(SCC(NCc2ccccc2)=O)nc(C)c1

InChI

InChI=1S/C23H23N3O2S/c1-16-13-17(2)25-23(21(16)22(28)26-19-11-7-4-8-12-19)29-15-20(27)24-14-18-9-5-3-6-10-18/h3-13H,14-15H2,1-2H3,(H,24,27)(H,26,28)

InChI Key

MTWOCLKBVORDFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10086958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.035

Distribution Coefficient, logD

4.034

Water Solubility, LogSw

-4.23

Polar Surface Area

56.083

Acid Dissociation Constant (pKa)

10.19

Base Dissociation Constant (pKb)

2.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

References: we are preparing a list of scientific research reports with D276-0041 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D276-0041?
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What is the minimum amount of D276-0041 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D276-0041
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D276-0041
  • 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 D276-0041 available by request