V001-5267 Screening compound: 1-[benzyl(propyl)amino]-3-(2-propynyloxy)-2-propanol

V001-5267 Screening compound: 1-[benzyl(propyl)amino]-3-(2-propynyloxy)-2-propanol
V001-5267 Screening compound: 1-[benzyl(propyl)amino]-3-(2-propynyloxy)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-5267
1-[benzyl(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

V001-5267

Molecular Formula

C16H23NO2 (C16 H23 NO2)

Compound Name

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

IUPAC name

benzyl[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl]propylamine

SMILES

CCCN(CC(COCC#C)O)Cc1ccccc1

InChI

InChI=1S/C16H23NO2/c1-3-10-17(12-15-8-6-5-7-9-15)13-16(18)14-19-11-4-2/h2,5-9,16,18H,3,10-14H2,1H3/t16-/m0/s1

InChI Key

XWARSCHUXURTDE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD10453287

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

261.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.340

Distribution Coefficient, logD

2.054

Water Solubility, LogSw

-2.23

Polar Surface Area

29.172

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

7.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

V001-5267 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 V001-5267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-5267?
Check Price and Availability of V001-5267, 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 V001-5267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-5267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-5267
  • 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 V001-5267 available by request