SD60-0098 Screening compound: 5-chloro-2-{3-[7-(2-methoxyethyl)-5-oxa-2-azaspiro[3.4]oct-2-yl]-3-oxopropyl}-1H-benzimidazole

SD60-0098 Screening compound: 5-chloro-2-{3-[7-(2-methoxyethyl)-5-oxa-2-azaspiro[3.4]oct-2-yl]-3-oxopropyl}-1H-benzimidazole
SD60-0098 Screening compound: 5-chloro-2-{3-[7-(2-methoxyethyl)-5-oxa-2-azaspiro[3.4]oct-2-yl]-3-oxopropyl}-1H-benzimidazole alternative view

Chemical Structure Depiction of ChemDiv screening compound SD60-0098
5-chloro-2-{3-[7-(2-methoxyethyl)-5-oxa-2-azaspiro[3.4]oct-2-yl]-3-oxopropyl}-1H-benzimidazole

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

SD60-0098

Molecular Formula

C19H24ClN3O3 (C19 H24 ClN3 O3)

Compound Name

5-chloro-2-{3-[7-(2-methoxyethyl)-5-oxa-2-azaspiro[3.4]oct-2-yl]-3-oxopropyl}-1H-benzimidazole

IUPAC name

n/a

SMILES

COCCC1COC(C2)(CN2C(CCc2nc(cc(cc3)Cl)c3[nH]2)=O)C1

InChI

InChI=1S/C19H24ClN3O3/c1-25-7-6-13-9-19(26-10-13)11-23(12-19)18(24)5-4-17-21-15-3-2-14(20)8-16(15)22-17/h2-3,8,13H,4-7,9-12H2,1H3,(H,21,22)/t13-/m1/s1

InChI Key

DRDCNGKPVMFMDN-CYBMUJFWSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.87

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.769

Distribution Coefficient, logD

2.702

Water Solubility, LogSw

-3.53

Polar Surface Area

52.647

Acid Dissociation Constant (pKa)

10.73

Base Dissociation Constant (pKb)

6.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.89

SD60-0098 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SD60-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SD60-0098?
Check Price and Availability of SD60-0098, 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 SD60-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SD60-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SD60-0098
  • 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 SD60-0098 available by request