L278-0113 Screening compound: 5-bromo-N~2~-methyl-N~2~-{[1-methyl-5-(1-pyrrolidinylcarbonyl)-1H-1,3-benzimidazol-2-yl]methyl}-2-thiophenesulfonamide

L278-0113 Screening compound: 5-bromo-N~2~-methyl-N~2~-{[1-methyl-5-(1-pyrrolidinylcarbonyl)-1H-1,3-benzimidazol-2-yl]methyl}-2-thiophenesulfonamide
L278-0113 Screening compound: 5-bromo-N~2~-methyl-N~2~-{[1-methyl-5-(1-pyrrolidinylcarbonyl)-1H-1,3-benzimidazol-2-yl]methyl}-2-thiophenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L278-0113
5-bromo-N~2~-methyl-N~2~-{[1-methyl-5-(1-pyrrolidinylcarbonyl)-1H-1,3-benzimidazol-2-yl]methyl}-2-thiophenesulfonamide

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

L278-0113

Molecular Formula

C19H21BrN4O3S2 (C19 H21 BrN4 O3 S2)

Compound Name

5-bromo-N~2~-methyl-N~2~-{[1-methyl-5-(1-pyrrolidinylcarbonyl)-1H-1,3-benzimidazol-2-yl]methyl}-2-thiophenesulfonamide

IUPAC name

5-bromo-N-methyl-N-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-13-benzodiazol-2-yl]methyl}thiophene-2-sulfonamide

SMILES

CN(Cc1nc(cc(cc2)C(N3CCCC3)=O)c2n1C)S(c(s1)ccc1Br)(=O)=O

InChI

InChI=1S/C19H21BrN4O3S2/c1-22(29(26,27)18-8-7-16(20)28-18)12-17-21-14-11-13(5-6-15(14)23(17)2)19(25)24-9-3-4-10-24/h5-8,11H,3-4,9-10,12H2,1-2H3

InChI Key

WFCPQUCXFUBLNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15122464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.837

Distribution Coefficient, logD

2.665

Water Solubility, LogSw

-3.34

Polar Surface Area

62.822

Acid Dissociation Constant (pKa)

26.49

Base Dissociation Constant (pKb)

7.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

L278-0113 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epigenetics Focused Set (26518 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 L278-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L278-0113?
Check Price and Availability of L278-0113, 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 L278-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L278-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L278-0113
  • 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 L278-0113 available by request