V030-5186 Screening compound: 3-bromo-N-[(2-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide

V030-5186 Screening compound: 3-bromo-N-[(2-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide
V030-5186 Screening compound: 3-bromo-N-[(2-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-5186
3-bromo-N-[(2-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-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

V030-5186

Molecular Formula

C22H18BrFN2OS (C22 H18 BrFN2 OS)

Compound Name

3-bromo-N-[(2-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-4H-thieno[3,2-b]pyrrole-5-carboxamide

IUPAC name

3-bromo-N-[(2-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-4H-thieno[32-b]pyrrole-5-carboxamide

SMILES

Cc1ccc(Cn(c(C(NCc(cccc2)c2F)=O)c2)c3c2scc3Br)cc1

InChI

InChI=1S/C22H18BrFN2OS/c1-14-6-8-15(9-7-14)12-26-19(10-20-21(26)17(23)13-28-20)22(27)25-11-16-4-2-3-5-18(16)24/h2-10,13H,11-12H2,1H3,(H,25,27)

InChI Key

KLAIUNRRJZLPSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19896730

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

457.37

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.075

Distribution Coefficient, logD

6.075

Water Solubility, LogSw

-5.41

Polar Surface Area

25.900

Acid Dissociation Constant (pKa)

12.40

Base Dissociation Constant (pKb)

-1.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with V030-5186 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-5186?
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What is the minimum amount of V030-5186 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-5186
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-5186
  • 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 V030-5186 available by request