V015-5353 Screening compound: 1-[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)propan-2-ol

V015-5353 Screening compound: 1-[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)propan-2-ol
V015-5353 Screening compound: 1-[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V015-5353
1-[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)propan-2-ol

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

V015-5353

Molecular Formula

C27H35FN2O3 (C27 H35 FN2 O3)

Compound Name

1-[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)propan-2-ol

IUPAC name

1-[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]-3-(4-methoxyphenoxy)propan-2-ol

SMILES

CC(C)CCN(CC(COc(cc1)ccc1OC)O)Cc1cccn1Cc(cc1)ccc1F

InChI

InChI=1S/C27H35FN2O3/c1-21(2)14-16-29(19-25(31)20-33-27-12-10-26(32-3)11-13-27)18-24-5-4-15-30(24)17-22-6-8-23(28)9-7-22/h4-13,15,21,25,31H,14,16-20H2,1-3H3/t25-/m0/s1

InChI Key

ZBMDOOLBSXAQMX-VWLOTQADSA-N

MDL Number (MFCD)

MFCD19775260

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

454.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.487

Distribution Coefficient, logD

5.413

Water Solubility, LogSw

-5.44

Polar Surface Area

37.661

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

6.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

References: we are preparing a list of scientific research reports with V015-5353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V015-5353?
Check Price and Availability of V015-5353, 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 V015-5353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V015-5353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V015-5353
  • 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 V015-5353 available by request