L126-0355 Screening compound: 4-bromo-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide

L126-0355 Screening compound: 4-bromo-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide
L126-0355 Screening compound: 4-bromo-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L126-0355
4-bromo-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]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

L126-0355

Molecular Formula

C18H26BrN3O4S (C18 H26 BrN3 O4 S)

Compound Name

4-bromo-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide

IUPAC name

4-bromo-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide

SMILES

O=C(c(cc1)ccc1Br)N(CCS(N1CCNCC1)(=O)=O)CC1OCCC1

InChI

InChI=1S/C18H26BrN3O4S/c19-16-5-3-15(4-6-16)18(23)21(14-17-2-1-12-26-17)11-13-27(24,25)22-9-7-20-8-10-22/h3-6,17,20H,1-2,7-14H2/t17-/m1/s1

InChI Key

WZUOMKBOPUDRKR-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD15118935

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

460.39

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.742

Distribution Coefficient, logD

0.398

Water Solubility, LogSw

-2.09

Polar Surface Area

68.648

Acid Dissociation Constant (pKa)

21.97

Base Dissociation Constant (pKb)

7.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

L126-0355 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with L126-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L126-0355?
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What is the minimum amount of L126-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L126-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L126-0355
  • 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 L126-0355 available by request