SD22-0006 Screening compound: N~1~-(1-isobutyl-3-{1-[(3-methylbenzyl)oxy]cyclopropyl}-3-azetanyl)acetamide

SD22-0006 Screening compound: N~1~-(1-isobutyl-3-{1-[(3-methylbenzyl)oxy]cyclopropyl}-3-azetanyl)acetamide
SD22-0006 Screening compound: N~1~-(1-isobutyl-3-{1-[(3-methylbenzyl)oxy]cyclopropyl}-3-azetanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD22-0006
N~1~-(1-isobutyl-3-{1-[(3-methylbenzyl)oxy]cyclopropyl}-3-azetanyl)acetamide

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

SD22-0006

Molecular Formula

C20H30N2O2 (C20 H30 N2 O2)

Compound Name

N~1~-(1-isobutyl-3-{1-[(3-methylbenzyl)oxy]cyclopropyl}-3-azetanyl)acetamide

IUPAC name

N-(3-{1-[(3-methylphenyl)methoxy]cyclopropyl}-1-(2-methylpropyl)azetidin-3-yl)acetamide

SMILES

CC(C)CN(C1)CC1(C1(CC1)OCc1cc(C)ccc1)NC(C)=O

InChI

InChI=1S/C20H30N2O2/c1-15(2)11-22-13-19(14-22,21-17(4)23)20(8-9-20)24-12-18-7-5-6-16(3)10-18/h5-7,10,15H,8-9,11-14H2,1-4H3,(H,21,23)

InChI Key

ACCZQOIMNAJIHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32260203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.240

Distribution Coefficient, logD

1.236

Water Solubility, LogSw

-3.31

Polar Surface Area

35.006

Acid Dissociation Constant (pKa)

15.00

Base Dissociation Constant (pKb)

9.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

SD22-0006 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SD22-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD22-0006?
Check Price and Availability of SD22-0006, 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 SD22-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD22-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD22-0006
  • 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 SD22-0006 available by request