D344-2501 Screening compound: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methylbutanamide

D344-2501 Screening compound: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methylbutanamide
D344-2501 Screening compound: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D344-2501
N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methylbutanamide

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

D344-2501

Molecular Formula

C19H19ClN2O2 (C19 H19 ClN2 O2)

Compound Name

N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methylbutanamide

IUPAC name

N-[5-(5-chloro-13-benzoxazol-2-yl)-2-methylphenyl]-3-methylbutanamide

SMILES

CC(C)CC(Nc1c(C)ccc(-c2nc(cc(cc3)Cl)c3o2)c1)=O

InChI

InChI=1S/C19H19ClN2O2/c1-11(2)8-18(23)21-15-9-13(5-4-12(15)3)19-22-16-10-14(20)6-7-17(16)24-19/h4-7,9-11H,8H2,1-3H3,(H,21,23)

InChI Key

KLTXUGICCYGAAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03059377

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.797

Distribution Coefficient, logD

4.797

Water Solubility, LogSw

-4.76

Polar Surface Area

39.500

Acid Dissociation Constant (pKa)

12.75

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D344-2501 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Agro:
  • Agro
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D344-2501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D344-2501?
Check Price and Availability of D344-2501, 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 D344-2501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D344-2501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D344-2501
  • 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 D344-2501 available by request