3029-1561 Screening compound: 5-(2,5-dichlorophenyl)-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]furan-2-carboxamide

3029-1561 Screening compound: 5-(2,5-dichlorophenyl)-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]furan-2-carboxamide
3029-1561 Screening compound: 5-(2,5-dichlorophenyl)-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3029-1561
5-(2,5-dichlorophenyl)-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]furan-2-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

3029-1561

Molecular Formula

C25H16Cl2N2O4 (C25 H16 Cl2 N2 O4)

Compound Name

5-(2,5-dichlorophenyl)-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]furan-2-carboxamide

IUPAC name

5-(25-dichlorophenyl)-N-[2-(4-methoxyphenyl)-13-benzoxazol-5-yl]furan-2-carboxamide

SMILES

COc(cc1)ccc1-c1nc(cc(cc2)NC(c3ccc(-c(cc(cc4)Cl)c4Cl)o3)=O)c2o1

InChI

InChI=1S/C25H16Cl2N2O4/c1-31-17-6-2-14(3-7-17)25-29-20-13-16(5-9-22(20)33-25)28-24(30)23-11-10-21(32-23)18-12-15(26)4-8-19(18)27/h2-13H,1H3,(H,28,30)

InChI Key

VQSTVAXJZXGXCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02085611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.934

Distribution Coefficient, logD

6.934

Water Solubility, LogSw

-6.50

Polar Surface Area

56.083

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

-2.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

References: we are preparing a list of scientific research reports with 3029-1561 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3029-1561?
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What is the minimum amount of 3029-1561 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3029-1561
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3029-1561
  • 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 3029-1561 available by request