V001-8762 Screening compound: [5-({[(furan-2-yl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]bis(4-methoxyphenyl)methanol

V001-8762 Screening compound: [5-({[(furan-2-yl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]bis(4-methoxyphenyl)methanol
V001-8762 Screening compound: [5-({[(furan-2-yl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]bis(4-methoxyphenyl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-8762
[5-({[(furan-2-yl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]bis(4-methoxyphenyl)methanol

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

V001-8762

Molecular Formula

C30H33NO6 (C30 H33 NO6)

Compound Name

[5-({[(furan-2-yl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]bis(4-methoxyphenyl)methanol

IUPAC name

[5-({[(furan-2-yl)methyl][(oxolan-2-yl)methyl]amino}methyl)furan-2-yl]bis(4-methoxyphenyl)methanol

SMILES

COc1ccc(C(c2ccc(CN(CC3OCCC3)Cc3ccco3)o2)(c(cc2)ccc2OC)O)cc1

InChI

InChI=1S/C30H33NO6/c1-33-24-11-7-22(8-12-24)30(32,23-9-13-25(34-2)14-10-23)29-16-15-28(37-29)21-31(19-26-5-3-17-35-26)20-27-6-4-18-36-27/h3,5,7-17,27,32H,4,6,18-21H2,1-2H3/t27-/m1/s1

InChI Key

XFYICYONOZARIV-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19869004

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

503.6

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.709

Distribution Coefficient, logD

4.691

Water Solubility, LogSw

-4.26

Polar Surface Area

57.536

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

6.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

V001-8762 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V001-8762 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-8762?
Check Price and Availability of V001-8762, 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 V001-8762 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-8762
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-8762
  • 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 V001-8762 available by request