4606-3688 Screening compound: N-[4-(acetamidosulfonyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

4606-3688 Screening compound: N-[4-(acetamidosulfonyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
4606-3688 Screening compound: N-[4-(acetamidosulfonyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4606-3688
N-[4-(acetamidosulfonyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-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

4606-3688

Molecular Formula

C19H17N3O5S (C19 H17 N3 O5 S)

Compound Name

N-[4-(acetamidosulfonyl)phenyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

IUPAC name

N-[4-(acetamidosulfonyl)phenyl]-5-methyl-3-phenyl-12-oxazole-4-carboxamide

SMILES

CC(NS(c(cc1)ccc1NC(c1c(C)onc1-c1ccccc1)=O)(=O)=O)=O

InChI

InChI=1S/C19H17N3O5S/c1-12-17(18(21-27-12)14-6-4-3-5-7-14)19(24)20-15-8-10-16(11-9-15)28(25,26)22-13(2)23/h3-11H,1-2H3,(H,20,24)(H,22,23)

InChI Key

OKUCBEDYMRFTQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01354437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.580

Distribution Coefficient, logD

-0.699

Water Solubility, LogSw

-2.49

Polar Surface Area

100.289

Acid Dissociation Constant (pKa)

5.12

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

4606-3688 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4606-3688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4606-3688?
Check Price and Availability of 4606-3688, 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 4606-3688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4606-3688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4606-3688
  • 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 4606-3688 available by request