V012-0816 Screening compound: 1-{[(2,3-dimethoxyphenyl)methyl](2-methylpropyl)amino}pentan-2-ol

V012-0816 Screening compound: 1-{[(2,3-dimethoxyphenyl)methyl](2-methylpropyl)amino}pentan-2-ol
V012-0816 Screening compound: 1-{[(2,3-dimethoxyphenyl)methyl](2-methylpropyl)amino}pentan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-0816
1-{[(2,3-dimethoxyphenyl)methyl](2-methylpropyl)amino}pentan-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

V012-0816

Molecular Formula

C18H31NO3 (C18 H31 NO3)

Compound Name

1-{[(2,3-dimethoxyphenyl)methyl](2-methylpropyl)amino}pentan-2-ol

IUPAC name

1-{[(23-dimethoxyphenyl)methyl](2-methylpropyl)amino}pentan-2-ol

SMILES

CCCC(CN(CC(C)C)Cc1cccc(OC)c1OC)O

InChI

InChI=1S/C18H31NO3/c1-6-8-16(20)13-19(11-14(2)3)12-15-9-7-10-17(21-4)18(15)22-5/h7,9-10,14,16,20H,6,8,11-13H2,1-5H3/t16-/m0/s1

InChI Key

JCDHXTBWGHBDHQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19839198

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

309.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.748

Distribution Coefficient, logD

1.848

Water Solubility, LogSw

-3.95

Polar Surface Area

36.189

Acid Dissociation Constant (pKa)

16.66

Base Dissociation Constant (pKb)

9.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.70

References: we are preparing a list of scientific research reports with V012-0816 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-0816?
Check Price and Availability of V012-0816, 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 V012-0816 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-0816
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-0816
  • 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 V012-0816 available by request