8001-3022 Screening compound: 3-(4-methylbenzenesulfonamido)propyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate

8001-3022 Screening compound: 3-(4-methylbenzenesulfonamido)propyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate
8001-3022 Screening compound: 3-(4-methylbenzenesulfonamido)propyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8001-3022
3-(4-methylbenzenesulfonamido)propyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate

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

8001-3022

Molecular Formula

C14H18N4O5S (C14 H18 N4 O5 S)

Compound Name

3-(4-methylbenzenesulfonamido)propyl N-(4-methyl-1,2,5-oxadiazol-3-yl)carbamate

IUPAC name

3-(4-methylbenzenesulfonamido)propyl N-(4-methyl-125-oxadiazol-3-yl)carbamate

SMILES

Cc1nonc1NC(OCCCNS(c1ccc(C)cc1)(=O)=O)=O

InChI

InChI=1S/C14H18N4O5S/c1-10-4-6-12(7-5-10)24(20,21)15-8-3-9-22-14(19)16-13-11(2)17-23-18-13/h4-7,15H,3,8-9H2,1-2H3,(H,16,18,19)

InChI Key

JKQDORZPQWENPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00473018

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.39

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.703

Distribution Coefficient, logD

2.638

Water Solubility, LogSw

-3.26

Polar Surface Area

110.411

Acid Dissociation Constant (pKa)

8.20

Base Dissociation Constant (pKb)

-3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

8001-3022 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8001-3022 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8001-3022?
Check Price and Availability of 8001-3022, 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 8001-3022 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8001-3022
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8001-3022
  • 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 8001-3022 available by request