L123-0480 Screening compound: N-[2-(furan-2-yl)ethyl]-4-[2-(3-methoxyphenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl]benzamide

L123-0480 Screening compound: N-[2-(furan-2-yl)ethyl]-4-[2-(3-methoxyphenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl]benzamide
L123-0480 Screening compound: N-[2-(furan-2-yl)ethyl]-4-[2-(3-methoxyphenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L123-0480
N-[2-(furan-2-yl)ethyl]-4-[2-(3-methoxyphenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl]benzamide

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

L123-0480

Molecular Formula

C29H30N2O3 (C29 H30 N2 O3)

Compound Name

N-[2-(furan-2-yl)ethyl]-4-[2-(3-methoxyphenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[b]pyrrol-1-yl]benzamide

IUPAC name

N-[2-(furan-2-yl)ethyl]-4-[2-(3-methoxyphenyl)-1H4H5H6H7H8H-cyclohepta[b]pyrrol-1-yl]benzamide

SMILES

COc1cccc(-c2cc(CCCCC3)c3n2-c(cc2)ccc2C(NCCc2ccco2)=O)c1

InChI

InChI=1S/C29H30N2O3/c1-33-26-9-5-8-22(19-26)28-20-23-7-3-2-4-11-27(23)31(28)24-14-12-21(13-15-24)29(32)30-17-16-25-10-6-18-34-25/h5-6,8-10,12-15,18-20H,2-4,7,11,16-17H2,1H3,(H,30,32)

InChI Key

DXQRBPNJHGPYRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15118899

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.57

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.010

Distribution Coefficient, logD

6.010

Water Solubility, LogSw

-5.24

Polar Surface Area

41.445

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

-1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.60

References: we are preparing a list of scientific research reports with L123-0480 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L123-0480?
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What is the minimum amount of L123-0480 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L123-0480
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L123-0480
  • 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 L123-0480 available by request