V010-9891 Screening compound: 1-{2-[(4-chloro-3-methylphenoxy)methyl]morpholino}-2-(3,4,5-trimethoxyphenyl)-1-ethanone

V010-9891 Screening compound: 1-{2-[(4-chloro-3-methylphenoxy)methyl]morpholino}-2-(3,4,5-trimethoxyphenyl)-1-ethanone
V010-9891 Screening compound: 1-{2-[(4-chloro-3-methylphenoxy)methyl]morpholino}-2-(3,4,5-trimethoxyphenyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-9891
1-{2-[(4-chloro-3-methylphenoxy)methyl]morpholino}-2-(3,4,5-trimethoxyphenyl)-1-ethanone

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

V010-9891

Molecular Formula

C23H28ClNO6 (C23 H28 ClNO6)

Compound Name

1-{2-[(4-chloro-3-methylphenoxy)methyl]morpholino}-2-(3,4,5-trimethoxyphenyl)-1-ethanone

IUPAC name

1-{2-[(4-chloro-3-methylphenoxy)methyl]morpholin-4-yl}-2-(345-trimethoxyphenyl)ethan-1-one

SMILES

Cc(cc(cc1)OCC(C2)OCCN2C(Cc(cc2OC)cc(OC)c2OC)=O)c1Cl

InChI

InChI=1S/C23H28ClNO6/c1-15-9-17(5-6-19(15)24)31-14-18-13-25(7-8-30-18)22(26)12-16-10-20(27-2)23(29-4)21(11-16)28-3/h5-6,9-11,18H,7-8,12-14H2,1-4H3/t18-/m1/s1

InChI Key

NBPIMZMJJIYNCD-GOSISDBHSA-N

MDL Number (MFCD)

MFCD19962812

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.93

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.879

Distribution Coefficient, logD

3.879

Water Solubility, LogSw

-4.22

Polar Surface Area

54.594

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

-2.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.48

V010-9891 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with V010-9891 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-9891?
Check Price and Availability of V010-9891, 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 V010-9891 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-9891
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-9891
  • 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 V010-9891 available by request