V009-8874 Screening compound: 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate

V009-8874 Screening compound: 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate
V009-8874 Screening compound: 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-8874
3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate

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

V009-8874

Molecular Formula

C24H31NO7 (C24 H31 NO7)

Compound Name

3-{[(2H-1,3-benzodioxol-5-yl)methyl][(3,4-dimethoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate

IUPAC name

3-{[(2H-13-benzodioxol-5-yl)methyl][(34-dimethoxyphenyl)methyl]amino}-2-hydroxypropyl butanoate

SMILES

CCCC(OCC(CN(Cc(cc1)cc2c1OCO2)Cc(cc1)cc(OC)c1OC)O)=O

InChI

InChI=1S/C24H31NO7/c1-4-5-24(27)30-15-19(26)14-25(12-17-6-8-20(28-2)22(10-17)29-3)13-18-7-9-21-23(11-18)32-16-31-21/h6-11,19,26H,4-5,12-16H2,1-3H3/t19-/m0/s1

InChI Key

HWCJLQJZPFTAJY-IBGZPJMESA-N

MDL Number (MFCD)

MFCD19839029

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

445.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.367

Distribution Coefficient, logD

1.107

Water Solubility, LogSw

-3.20

Polar Surface Area

73.480

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

9.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with V009-8874 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-8874?
Check Price and Availability of V009-8874, 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 V009-8874 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-8874
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-8874
  • 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 V009-8874 available by request