V010-8535 Screening compound: 1-[(4-methoxybenzyl)(propyl)amino]-3-(2-propynyloxy)-2-propanol

V010-8535 Screening compound: 1-[(4-methoxybenzyl)(propyl)amino]-3-(2-propynyloxy)-2-propanol
V010-8535 Screening compound: 1-[(4-methoxybenzyl)(propyl)amino]-3-(2-propynyloxy)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-8535
1-[(4-methoxybenzyl)(propyl)amino]-3-(2-propynyloxy)-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

V010-8535

Molecular Formula

C17H25NO3 (C17 H25 NO3)

Compound Name

1-[(4-methoxybenzyl)(propyl)amino]-3-(2-propynyloxy)-2-propanol

IUPAC name

[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl][(4-methoxyphenyl)methyl]propylamine

SMILES

CCCN(CC(COCC#C)O)Cc(cc1)ccc1OC

InChI

InChI=1S/C17H25NO3/c1-4-10-18(13-16(19)14-21-11-5-2)12-15-6-8-17(20-3)9-7-15/h2,6-9,16,19H,4,10-14H2,1,3H3/t16-/m0/s1

InChI Key

CJPUFNSVPSEUQL-INIZCTEOSA-N

MDL Number (MFCD)

MFCD10453202

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

291.39

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

2.322

Distribution Coefficient, logD

2.143

Water Solubility, LogSw

-2.25

Polar Surface Area

36.716

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.94

V010-8535 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V010-8535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-8535?
Check Price and Availability of V010-8535, 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 V010-8535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-8535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-8535
  • 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 V010-8535 available by request