M023-0062 Screening compound: 1-({4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophen-2-yl}sulfonyl)-2,3-dihydro-1H-indole

M023-0062 Screening compound: 1-({4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophen-2-yl}sulfonyl)-2,3-dihydro-1H-indole
M023-0062 Screening compound: 1-({4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophen-2-yl}sulfonyl)-2,3-dihydro-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound M023-0062
1-({4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophen-2-yl}sulfonyl)-2,3-dihydro-1H-indole

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

M023-0062

Molecular Formula

C21H21N3O3S3 (C21 H21 N3 O3 S3)

Compound Name

1-({4-[4-methyl-5-(pyrrolidine-1-carbonyl)-1,3-thiazol-2-yl]thiophen-2-yl}sulfonyl)-2,3-dihydro-1H-indole

IUPAC name

1-({4-[4-methyl-5-(pyrrolidine-1-carbonyl)-13-thiazol-2-yl]thiophen-2-yl}sulfonyl)-23-dihydro-1H-indole

SMILES

Cc1c(C(N2CCCC2)=O)sc(-c2csc(S(N(CC3)c4c3cccc4)(=O)=O)c2)n1

InChI

InChI=1S/C21H21N3O3S3/c1-14-19(21(25)23-9-4-5-10-23)29-20(22-14)16-12-18(28-13-16)30(26,27)24-11-8-15-6-2-3-7-17(15)24/h2-3,6-7,12-13H,4-5,8-11H2,1H3

InChI Key

OJIPKETZEZSMMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27493242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.61

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.127

Distribution Coefficient, logD

4.127

Water Solubility, LogSw

-4.20

Polar Surface Area

60.100

Acid Dissociation Constant (pKa)

26.08

Base Dissociation Constant (pKb)

2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

M023-0062 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M023-0062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M023-0062?
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What is the minimum amount of M023-0062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M023-0062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M023-0062
  • 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 M023-0062 available by request