V009-1701 Screening compound: methyl 2-({[(1-benzyl-1H-pyrrol-2-yl)methyl](3-methylbutyl)amino}methyl)benzoate

V009-1701 Screening compound: methyl 2-({[(1-benzyl-1H-pyrrol-2-yl)methyl](3-methylbutyl)amino}methyl)benzoate
V009-1701 Screening compound: methyl 2-({[(1-benzyl-1H-pyrrol-2-yl)methyl](3-methylbutyl)amino}methyl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-1701
methyl 2-({[(1-benzyl-1H-pyrrol-2-yl)methyl](3-methylbutyl)amino}methyl)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

V009-1701

Molecular Formula

C26H32N2O2 (C26 H32 N2 O2)

Compound Name

methyl 2-({[(1-benzyl-1H-pyrrol-2-yl)methyl](3-methylbutyl)amino}methyl)benzoate

IUPAC name

methyl 2-({[(1-benzyl-1H-pyrrol-2-yl)methyl](3-methylbutyl)amino}methyl)benzoate

SMILES

CC(C)CCN(Cc1cccn1Cc1ccccc1)Cc(cccc1)c1C(OC)=O

InChI

InChI=1S/C26H32N2O2/c1-21(2)15-17-27(19-23-12-7-8-14-25(23)26(29)30-3)20-24-13-9-16-28(24)18-22-10-5-4-6-11-22/h4-14,16,21H,15,17-20H2,1-3H3

InChI Key

WFEUGWPSCWPWQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19775317

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

404.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.766

Distribution Coefficient, logD

5.041

Water Solubility, LogSw

-5.55

Polar Surface Area

27.173

Acid Dissociation Constant (pKa)

26.41

Base Dissociation Constant (pKb)

8.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

V009-1701 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CORONAVIRUS Library (20774 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V009-1701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-1701?
Check Price and Availability of V009-1701, 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 V009-1701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-1701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-1701
  • 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 V009-1701 available by request