M021-0205 Screening compound: methyl 4-{2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-3-sulfonamido}benzoate

M021-0205 Screening compound: methyl 4-{2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-3-sulfonamido}benzoate
M021-0205 Screening compound: methyl 4-{2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-3-sulfonamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound M021-0205
methyl 4-{2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-3-sulfonamido}benzoate

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

M021-0205

Molecular Formula

C20H20N4O6S2 (C20 H20 N4 O6 S2)

Compound Name

methyl 4-{2-methyl-5-[5-(pyrrolidine-1-carbonyl)-1,3,4-oxadiazol-2-yl]thiophene-3-sulfonamido}benzoate

IUPAC name

methyl 4-{2-methyl-5-[5-(pyrrolidine-1-carbonyl)-134-oxadiazol-2-yl]thiophene-3-sulfonamido}benzoate

SMILES

Cc(sc(-c1nnc(C(N2CCCC2)=O)o1)c1)c1S(Nc(cc1)ccc1C(OC)=O)(=O)=O

InChI

InChI=1S/C20H20N4O6S2/c1-12-16(32(27,28)23-14-7-5-13(6-8-14)20(26)29-2)11-15(31-12)17-21-22-18(30-17)19(25)24-9-3-4-10-24/h5-8,11,23H,3-4,9-10H2,1-2H3

InChI Key

HXYFCFYMAAHTRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27492905

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.53

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.865

Distribution Coefficient, logD

2.704

Water Solubility, LogSw

-3.52

Polar Surface Area

110.610

Acid Dissociation Constant (pKa)

7.75

Base Dissociation Constant (pKb)

-4.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with M021-0205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M021-0205?
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What is the minimum amount of M021-0205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M021-0205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M021-0205
  • 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 M021-0205 available by request