2276-0569 Screening compound: N-[4-chloro-3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,4,5-trimethoxybenzamide

2276-0569 Screening compound: N-[4-chloro-3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,4,5-trimethoxybenzamide
2276-0569 Screening compound: N-[4-chloro-3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2276-0569
N-[4-chloro-3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,4,5-trimethoxybenzamide

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

2276-0569

Molecular Formula

C23H18Cl2N2O5 (C23 H18 Cl2 N2 O5)

Compound Name

N-[4-chloro-3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-3,4,5-trimethoxybenzamide

IUPAC name

N-[4-chloro-3-(5-chloro-13-benzoxazol-2-yl)phenyl]-345-trimethoxybenzamide

SMILES

COc1cc(C(Nc(cc2)cc(-c3nc(cc(cc4)Cl)c4o3)c2Cl)=O)cc(OC)c1OC

InChI

InChI=1S/C23H18Cl2N2O5/c1-29-19-8-12(9-20(30-2)21(19)31-3)22(28)26-14-5-6-16(25)15(11-14)23-27-17-10-13(24)4-7-18(17)32-23/h4-11H,1-3H3,(H,26,28)

InChI Key

XSOYDHWBYVIJQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01840887

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.506

Distribution Coefficient, logD

5.506

Water Solubility, LogSw

-5.96

Polar Surface Area

63.118

Acid Dissociation Constant (pKa)

11.59

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

2276-0569 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 2276-0569 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2276-0569?
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What is the minimum amount of 2276-0569 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2276-0569
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2276-0569
  • 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 2276-0569 available by request