2977-1082 Screening compound: N~1~-dibenzo[b,d]furan-3-yl-4-isobutoxybenzamide

2977-1082 Screening compound: N~1~-dibenzo[b,d]furan-3-yl-4-isobutoxybenzamide
2977-1082 Screening compound: N~1~-dibenzo[b,d]furan-3-yl-4-isobutoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2977-1082
N~1~-dibenzo[b,d]furan-3-yl-4-isobutoxybenzamide

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

2977-1082

Molecular Formula

C23H21NO3 (C23 H21 NO3)

Compound Name

N~1~-dibenzo[b,d]furan-3-yl-4-isobutoxybenzamide

IUPAC name

4-(2-methylpropoxy)-N-{8-oxatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaen-5-yl}benzamide

SMILES

CC(C)COc(cc1)ccc1C(Nc(cc1)cc2c1c(cccc1)c1o2)=O

InChI

InChI=1S/C23H21NO3/c1-15(2)14-26-18-10-7-16(8-11-18)23(25)24-17-9-12-20-19-5-3-4-6-21(19)27-22(20)13-17/h3-13,15H,14H2,1-2H3,(H,24,25)

InChI Key

VDKBIHGKLUDSIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01648500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.438

Distribution Coefficient, logD

6.438

Water Solubility, LogSw

-5.99

Polar Surface Area

38.744

Acid Dissociation Constant (pKa)

11.69

Base Dissociation Constant (pKb)

-1.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

2977-1082 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 2977-1082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2977-1082?
Check Price and Availability of 2977-1082, 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 2977-1082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2977-1082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2977-1082
  • 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 2977-1082 available by request