V002-4563 Screening compound: 1-{(3-methoxypropyl)[(5-methyl-2-thienyl)methyl]amino}-3-(2-methylphenoxy)-2-propanol

V002-4563 Screening compound: 1-{(3-methoxypropyl)[(5-methyl-2-thienyl)methyl]amino}-3-(2-methylphenoxy)-2-propanol
V002-4563 Screening compound: 1-{(3-methoxypropyl)[(5-methyl-2-thienyl)methyl]amino}-3-(2-methylphenoxy)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-4563
1-{(3-methoxypropyl)[(5-methyl-2-thienyl)methyl]amino}-3-(2-methylphenoxy)-2-propanol

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

V002-4563

Molecular Formula

C20H29NO3S (C20 H29 NO3 S)

Compound Name

1-{(3-methoxypropyl)[(5-methyl-2-thienyl)methyl]amino}-3-(2-methylphenoxy)-2-propanol

IUPAC name

n/a

SMILES

Cc1ccc(CN(CCCOC)CC(COc2c(C)cccc2)O)s1

InChI

InChI=1S/C20H29NO3S/c1-16-7-4-5-8-20(16)24-15-18(22)13-21(11-6-12-23-3)14-19-10-9-17(2)25-19/h4-5,7-10,18,22H,6,11-15H2,1-3H3/t18-/m0/s1

InChI Key

UHJYJAVYGULDSU-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19840634

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.350

Distribution Coefficient, logD

3.496

Water Solubility, LogSw

-4.24

Polar Surface Area

37.495

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

8.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with V002-4563 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-4563?
Check Price and Availability of V002-4563, 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 V002-4563 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-4563
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-4563
  • 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 V002-4563 available by request