3455-1404 Screening compound: 2,6-dibutoxy-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]benzamide

3455-1404 Screening compound: 2,6-dibutoxy-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]benzamide
3455-1404 Screening compound: 2,6-dibutoxy-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3455-1404
2,6-dibutoxy-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]benzamide

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

3455-1404

Molecular Formula

C24H31NO5 (C24 H31 NO5)

Compound Name

2,6-dibutoxy-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]benzamide

IUPAC name

26-dibutoxy-N-[(23-dihydro-14-benzodioxin-2-yl)methyl]benzamide

SMILES

CCCCOc1cccc(OCCCC)c1C(NCC1Oc(cccc2)c2OC1)=O

InChI

InChI=1S/C24H31NO5/c1-3-5-14-27-21-12-9-13-22(28-15-6-4-2)23(21)24(26)25-16-18-17-29-19-10-7-8-11-20(19)30-18/h7-13,18H,3-6,14-17H2,1-2H3,(H,25,26)/t18-/m0/s1

InChI Key

WOQVOMSCNMBJJV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD01993127

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.464

Distribution Coefficient, logD

5.464

Water Solubility, LogSw

-5.53

Polar Surface Area

55.340

Acid Dissociation Constant (pKa)

10.67

Base Dissociation Constant (pKb)

-2.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with 3455-1404 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3455-1404?
Check Price and Availability of 3455-1404, 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 3455-1404 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3455-1404
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3455-1404
  • 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 3455-1404 available by request