V009-5549 Screening compound: benzyl(cyclohexylmethyl)[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amine

V009-5549 Screening compound: benzyl(cyclohexylmethyl)[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amine
V009-5549 Screening compound: benzyl(cyclohexylmethyl)[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-5549
benzyl(cyclohexylmethyl)[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amine

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

V009-5549

Molecular Formula

C27H31F3N2 (C27 H31 F3 N2)

Compound Name

benzyl(cyclohexylmethyl)[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amine

IUPAC name

benzyl(cyclohexylmethyl)[(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-pyrrol-2-yl)methyl]amine

SMILES

FC(c1ccc(Cn2c(CN(CC3CCCCC3)Cc3ccccc3)ccc2)cc1)(F)F

InChI

InChI=1S/C27H31F3N2/c28-27(29,30)25-15-13-24(14-16-25)20-32-17-7-12-26(32)21-31(18-22-8-3-1-4-9-22)19-23-10-5-2-6-11-23/h1,3-4,7-9,12-17,23H,2,5-6,10-11,18-21H2

InChI Key

UMNNMTQPXJIMCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19775462

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

440.55

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.203

Distribution Coefficient, logD

7.153

Water Solubility, LogSw

-6.42

Polar Surface Area

5.941

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

6.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V009-5549 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

Antiviral Library (67538 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with V009-5549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-5549?
Check Price and Availability of V009-5549, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V009-5549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-5549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-5549
  • 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 V009-5549 available by request