E146-0878 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide

E146-0878 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide
E146-0878 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E146-0878
N-{3-[benzyl(methyl)amino]propyl}-4H-thiochromeno[3,4-d][1,2]oxazole-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

E146-0878

Molecular Formula

C22H23N3O2S (C22 H23 N3 O2 S)

Compound Name

N-{3-[benzyl(methyl)amino]propyl}-4H-thiochromeno[3,4-d][1,2]oxazole-3-carboxamide

IUPAC name

N-{3-[benzyl(methyl)amino]propyl}-4H-thiochromeno[34-d][12]oxazole-3-carboxamide

SMILES

CN(CCCNC(c1noc-2c1CSc1c2cccc1)=O)Cc1ccccc1

InChI

InChI=1S/C22H23N3O2S/c1-25(14-16-8-3-2-4-9-16)13-7-12-23-22(26)20-18-15-28-19-11-6-5-10-17(19)21(18)27-24-20/h2-6,8-11H,7,12-15H2,1H3,(H,23,26)

InChI Key

WVFNREQIYPCSPA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14842789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.329

Distribution Coefficient, logD

1.888

Water Solubility, LogSw

-3.85

Polar Surface Area

50.668

Acid Dissociation Constant (pKa)

14.74

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

E146-0878 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with E146-0878 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E146-0878?
Check Price and Availability of E146-0878, 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 E146-0878 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E146-0878
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E146-0878
  • 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 E146-0878 available by request