4192-0300 Screening compound: N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-methoxy-4-propoxybenzamide

4192-0300 Screening compound: N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-methoxy-4-propoxybenzamide
4192-0300 Screening compound: N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-methoxy-4-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4192-0300
N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-methoxy-4-propoxybenzamide

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

4192-0300

Molecular Formula

C20H23NO5 (C20 H23 NO5)

Compound Name

N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-3-methoxy-4-propoxybenzamide

IUPAC name

N-[(23-dihydro-14-benzodioxin-2-yl)methyl]-3-methoxy-4-propoxybenzamide

SMILES

CCCOc(ccc(C(NCC1Oc(cccc2)c2OC1)=O)c1)c1OC

InChI

InChI=1S/C20H23NO5/c1-3-10-24-17-9-8-14(11-19(17)23-2)20(22)21-12-15-13-25-16-6-4-5-7-18(16)26-15/h4-9,11,15H,3,10,12-13H2,1-2H3,(H,21,22)/t15-/m0/s1

InChI Key

SAHMRYNLOJOGLO-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD02030132

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

357.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.197

Distribution Coefficient, logD

3.197

Water Solubility, LogSw

-3.34

Polar Surface Area

55.466

Acid Dissociation Constant (pKa)

14.15

Base Dissociation Constant (pKb)

-3.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

4192-0300 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4192-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4192-0300?
Check Price and Availability of 4192-0300, 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 4192-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4192-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4192-0300
  • 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 4192-0300 available by request