3379-1173 Screening compound: N-[3-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]furan-2-carboxamide

3379-1173 Screening compound: N-[3-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]furan-2-carboxamide
3379-1173 Screening compound: N-[3-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3379-1173
N-[3-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]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

3379-1173

Molecular Formula

C30H27NO7 (C30 H27 NO7)

Compound Name

N-[3-(2H-1,3-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-[(2H-1,3-benzodioxol-5-yl)methyl]furan-2-carboxamide

IUPAC name

N-[3-(2H-13-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-[(2H-13-benzodioxol-5-yl)methyl]furan-2-carboxamide

SMILES

COc1c(C(CCN(Cc(cc2)cc3c2OCO3)C(c2ccco2)=O)c(cc2)cc3c2OCO3)cccc1

InChI

InChI=1S/C30H27NO7/c1-33-24-6-3-2-5-23(24)22(21-9-11-26-29(16-21)38-19-36-26)12-13-31(30(32)27-7-4-14-34-27)17-20-8-10-25-28(15-20)37-18-35-25/h2-11,14-16,22H,12-13,17-19H2,1H3/t22-/m0/s1

InChI Key

XZXPIXAGIWLAGW-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD02927688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

513.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.538

Distribution Coefficient, logD

5.538

Water Solubility, LogSw

-5.48

Polar Surface Area

66.324

Acid Dissociation Constant (pKa)

25.24

Base Dissociation Constant (pKb)

-2.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with 3379-1173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3379-1173?
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What is the minimum amount of 3379-1173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3379-1173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3379-1173
  • 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 3379-1173 available by request