V030-6839 Screening compound: 1-[isopropyl(2-thienylmethyl)amino]-3-(2-propynyloxy)-2-propanol

V030-6839 Screening compound: 1-[isopropyl(2-thienylmethyl)amino]-3-(2-propynyloxy)-2-propanol
V030-6839 Screening compound: 1-[isopropyl(2-thienylmethyl)amino]-3-(2-propynyloxy)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-6839
1-[isopropyl(2-thienylmethyl)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

V030-6839

Molecular Formula

C14H21NO2S (C14 H21 NO2 S)

Compound Name

1-[isopropyl(2-thienylmethyl)amino]-3-(2-propynyloxy)-2-propanol

IUPAC name

[2-hydroxy-3-(prop-2-yn-1-yloxy)propyl](propan-2-yl)[(thiophen-2-yl)methyl]amine

SMILES

CC(C)N(CC(COCC#C)O)Cc1cccs1

InChI

InChI=1S/C14H21NO2S/c1-4-7-17-11-13(16)9-15(12(2)3)10-14-6-5-8-18-14/h1,5-6,8,12-13,16H,7,9-11H2,2-3H3/t13-/m0/s1

InChI Key

MATDOKTVNWUPQW-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD10453911

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

267.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.047

Distribution Coefficient, logD

1.681

Water Solubility, LogSw

-2.14

Polar Surface Area

29.848

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

7.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

V030-6839 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V030-6839 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-6839?
Check Price and Availability of V030-6839, 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 V030-6839 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-6839
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-6839
  • 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 V030-6839 available by request