V030-0482 Screening compound: 1-{[(furan-2-yl)methyl][(3-methylphenyl)methyl]amino}pentan-2-ol

V030-0482 Screening compound: 1-{[(furan-2-yl)methyl][(3-methylphenyl)methyl]amino}pentan-2-ol
V030-0482 Screening compound: 1-{[(furan-2-yl)methyl][(3-methylphenyl)methyl]amino}pentan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-0482
1-{[(furan-2-yl)methyl][(3-methylphenyl)methyl]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

V030-0482

Molecular Formula

C18H25NO2 (C18 H25 NO2)

Compound Name

1-{[(furan-2-yl)methyl][(3-methylphenyl)methyl]amino}pentan-2-ol

IUPAC name

1-{[(furan-2-yl)methyl][(3-methylphenyl)methyl]amino}pentan-2-ol

SMILES

CCCC(CN(Cc1ccco1)Cc1cc(C)ccc1)O

InChI

InChI=1S/C18H25NO2/c1-3-6-17(20)13-19(14-18-9-5-10-21-18)12-16-8-4-7-15(2)11-16/h4-5,7-11,17,20H,3,6,12-14H2,1-2H3/t17-/m0/s1

InChI Key

CWFMGLCMPNSLFA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD19836985

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

287.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.042

Distribution Coefficient, logD

3.996

Water Solubility, LogSw

-3.92

Polar Surface Area

28.318

Acid Dissociation Constant (pKa)

16.66

Base Dissociation Constant (pKb)

6.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

44.40

V030-0482 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with V030-0482 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-0482?
Check Price and Availability of V030-0482, 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 V030-0482 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-0482
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-0482
  • 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 V030-0482 available by request