V021-6557 Screening compound: 1-{3-bromo-4-[(2-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}pyrrolidine

V021-6557 Screening compound: 1-{3-bromo-4-[(2-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}pyrrolidine
V021-6557 Screening compound: 1-{3-bromo-4-[(2-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}pyrrolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-6557
1-{3-bromo-4-[(2-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}pyrrolidine

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

V021-6557

Molecular Formula

C19H19BrN2OS (C19 H19 BrN2 OS)

Compound Name

1-{3-bromo-4-[(2-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carbonyl}pyrrolidine

IUPAC name

1-{3-bromo-4-[(2-methylphenyl)methyl]-4H-thieno[32-b]pyrrole-5-carbonyl}pyrrolidine

SMILES

Cc1c(Cn(c(C(N2CCCC2)=O)c2)c3c2scc3Br)cccc1

InChI

InChI=1S/C19H19BrN2OS/c1-13-6-2-3-7-14(13)11-22-16(19(23)21-8-4-5-9-21)10-17-18(22)15(20)12-24-17/h2-3,6-7,10,12H,4-5,8-9,11H2,1H3

InChI Key

IQGCLPAXFQHLPY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19896808

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.262

Distribution Coefficient, logD

5.262

Water Solubility, LogSw

-5.05

Polar Surface Area

18.501

Acid Dissociation Constant (pKa)

26.07

Base Dissociation Constant (pKb)

-1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with V021-6557 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-6557?
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What is the minimum amount of V021-6557 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-6557
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-6557
  • 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 V021-6557 available by request