L422-0453 Screening compound: N-cycloheptyl-5-{[4-(2-methylbenzamido)phenoxy]methyl}-1,2-oxazole-3-carboxamide

L422-0453 Screening compound: N-cycloheptyl-5-{[4-(2-methylbenzamido)phenoxy]methyl}-1,2-oxazole-3-carboxamide
L422-0453 Screening compound: N-cycloheptyl-5-{[4-(2-methylbenzamido)phenoxy]methyl}-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L422-0453
N-cycloheptyl-5-{[4-(2-methylbenzamido)phenoxy]methyl}-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

L422-0453

Molecular Formula

C26H29N3O4 (C26 H29 N3 O4)

Compound Name

N-cycloheptyl-5-{[4-(2-methylbenzamido)phenoxy]methyl}-1,2-oxazole-3-carboxamide

IUPAC name

N-cycloheptyl-5-{[4-(2-methylbenzamido)phenoxy]methyl}-12-oxazole-3-carboxamide

SMILES

Cc(cccc1)c1C(Nc(cc1)ccc1OCc1cc(C(NC2CCCCCC2)=O)no1)=O

InChI

InChI=1S/C26H29N3O4/c1-18-8-6-7-11-23(18)25(30)27-20-12-14-21(15-13-20)32-17-22-16-24(29-33-22)26(31)28-19-9-4-2-3-5-10-19/h6-8,11-16,19H,2-5,9-10,17H2,1H3,(H,27,30)(H,28,31)

InChI Key

MLYSZZFRGIADAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27251650

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.293

Distribution Coefficient, logD

5.292

Water Solubility, LogSw

-5.20

Polar Surface Area

76.004

Acid Dissociation Constant (pKa)

10.35

Base Dissociation Constant (pKb)

2.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

L422-0453 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with L422-0453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L422-0453?
Check Price and Availability of L422-0453, 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 L422-0453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L422-0453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L422-0453
  • 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 L422-0453 available by request