SD22-1271 Screening compound: N~1~-[3-(1-methoxycyclopropyl)-1-(3-thienylcarbonyl)-3-azetanyl]-1-cyclopentanecarboxamide

SD22-1271 Screening compound: N~1~-[3-(1-methoxycyclopropyl)-1-(3-thienylcarbonyl)-3-azetanyl]-1-cyclopentanecarboxamide
SD22-1271 Screening compound: N~1~-[3-(1-methoxycyclopropyl)-1-(3-thienylcarbonyl)-3-azetanyl]-1-cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SD22-1271
N~1~-[3-(1-methoxycyclopropyl)-1-(3-thienylcarbonyl)-3-azetanyl]-1-cyclopentanecarboxamide

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

SD22-1271

Molecular Formula

C18H24N2O3S (C18 H24 N2 O3 S)

Compound Name

N~1~-[3-(1-methoxycyclopropyl)-1-(3-thienylcarbonyl)-3-azetanyl]-1-cyclopentanecarboxamide

IUPAC name

n/a

SMILES

COC1(CC1)C(C1)(CN1C(c1cscc1)=O)NC(C1CCCC1)=O

InChI

InChI=1S/C18H24N2O3S/c1-23-18(7-8-18)17(19-15(21)13-4-2-3-5-13)11-20(12-17)16(22)14-6-9-24-10-14/h6,9-10,13H,2-5,7-8,11-12H2,1H3,(H,19,21)

InChI Key

JNXDOYONHNOLHA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.960

Distribution Coefficient, logD

1.960

Water Solubility, LogSw

-2.58

Polar Surface Area

49.372

Acid Dissociation Constant (pKa)

14.50

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.67

SD22-1271 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SD22-1271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD22-1271?
Check Price and Availability of SD22-1271, 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 SD22-1271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD22-1271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD22-1271
  • 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 SD22-1271 available by request