M027-1321 Screening compound: N-[2-(dimethylamino)ethyl]-3-[2-(4-methoxybenzenesulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide

M027-1321 Screening compound: N-[2-(dimethylamino)ethyl]-3-[2-(4-methoxybenzenesulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
M027-1321 Screening compound: N-[2-(dimethylamino)ethyl]-3-[2-(4-methoxybenzenesulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M027-1321
N-[2-(dimethylamino)ethyl]-3-[2-(4-methoxybenzenesulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide

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

M027-1321

Molecular Formula

C16H22N4O5S (C16 H22 N4 O5 S)

Compound Name

N-[2-(dimethylamino)ethyl]-3-[2-(4-methoxybenzenesulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

N-[2-(dimethylamino)ethyl]-3-[2-(4-methoxybenzenesulfonyl)ethyl]-124-oxadiazole-5-carboxamide

SMILES

CN(C)CCNC(c1nc(CCS(c(cc2)ccc2OC)(=O)=O)no1)=O

InChI

InChI=1S/C16H22N4O5S/c1-20(2)10-9-17-15(21)16-18-14(19-25-16)8-11-26(22,23)13-6-4-12(24-3)5-7-13/h4-7H,8-11H2,1-3H3,(H,17,21)

InChI Key

YXQRYNMQSNCTJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27493696

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.44

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.415

Distribution Coefficient, logD

-1.031

Water Solubility, LogSw

-2.30

Polar Surface Area

97.878

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.80

M027-1321 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M027-1321 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M027-1321?
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What is the minimum amount of M027-1321 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M027-1321
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M027-1321
  • 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 M027-1321 available by request