V030-8250 Screening compound: 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(2-methylphenyl)methyl]amino}-2-hydroxypropyl butanoate

V030-8250 Screening compound: 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(2-methylphenyl)methyl]amino}-2-hydroxypropyl butanoate
V030-8250 Screening compound: 3-{[(2H-1,3-benzodioxol-5-yl)methyl][(2-methylphenyl)methyl]amino}-2-hydroxypropyl butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8250
3-{[(2H-1,3-benzodioxol-5-yl)methyl][(2-methylphenyl)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

V030-8250

Molecular Formula

C23H29NO5 (C23 H29 NO5)

Compound Name

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

IUPAC name

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

SMILES

CCCC(OCC(CN(Cc(cc1)cc2c1OCO2)Cc1c(C)cccc1)O)=O

InChI

InChI=1S/C23H29NO5/c1-3-6-23(26)27-15-20(25)14-24(13-19-8-5-4-7-17(19)2)12-18-9-10-21-22(11-18)29-16-28-21/h4-5,7-11,20,25H,3,6,12-16H2,1-2H3/t20-/m0/s1

InChI Key

BBQUCCYAODIDTL-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD19841058

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.567

Distribution Coefficient, logD

3.654

Water Solubility, LogSw

-4.29

Polar Surface Area

58.219

Acid Dissociation Constant (pKa)

16.26

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V030-8250 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8250?
Check Price and Availability of V030-8250, 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 V030-8250 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8250
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8250
  • 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 V030-8250 available by request