L364-0066 Screening compound: 4-[5-(2,3-dihydro-1,4-benzodioxine-6-sulfonamido)-1-methyl-1H-1,3-benzodiazol-2-yl]-N-methylbenzamide

L364-0066 Screening compound: 4-[5-(2,3-dihydro-1,4-benzodioxine-6-sulfonamido)-1-methyl-1H-1,3-benzodiazol-2-yl]-N-methylbenzamide
L364-0066 Screening compound: 4-[5-(2,3-dihydro-1,4-benzodioxine-6-sulfonamido)-1-methyl-1H-1,3-benzodiazol-2-yl]-N-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L364-0066
4-[5-(2,3-dihydro-1,4-benzodioxine-6-sulfonamido)-1-methyl-1H-1,3-benzodiazol-2-yl]-N-methylbenzamide

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

L364-0066

Molecular Formula

C24H22N4O5S (C24 H22 N4 O5 S)

Compound Name

4-[5-(2,3-dihydro-1,4-benzodioxine-6-sulfonamido)-1-methyl-1H-1,3-benzodiazol-2-yl]-N-methylbenzamide

IUPAC name

4-[5-(23-dihydro-14-benzodioxine-6-sulfonamido)-1-methyl-1H-13-benzodiazol-2-yl]-N-methylbenzamide

SMILES

CNC(c(cc1)ccc1-c1nc(cc(cc2)NS(c(cc3)cc4c3OCCO4)(=O)=O)c2n1C)=O

InChI

InChI=1S/C24H22N4O5S/c1-25-24(29)16-5-3-15(4-6-16)23-26-19-13-17(7-9-20(19)28(23)2)27-34(30,31)18-8-10-21-22(14-18)33-12-11-32-21/h3-10,13-14,27H,11-12H2,1-2H3,(H,25,29)

InChI Key

VSKAVBYSXOAFBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27247822

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.472

Distribution Coefficient, logD

2.468

Water Solubility, LogSw

-3.02

Polar Surface Area

92.285

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

L364-0066 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with L364-0066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L364-0066?
Check Price and Availability of L364-0066, 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 L364-0066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L364-0066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L364-0066
  • 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 L364-0066 available by request