SC66-0372 Screening compound: [4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]dec-2-yl](3-methylphenyl)methanone

SC66-0372 Screening compound: [4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]dec-2-yl](3-methylphenyl)methanone
SC66-0372 Screening compound: [4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]dec-2-yl](3-methylphenyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC66-0372
[4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]dec-2-yl](3-methylphenyl)methanone

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

SC66-0372

Molecular Formula

C21H26N4O2 (C21 H26 N4 O2)

Compound Name

[4-(4-cyclopropyl-4H-1,2,4-triazol-3-yl)-8-oxa-2-azaspiro[4.5]dec-2-yl](3-methylphenyl)methanone

IUPAC name

4-(4-cyclopropyl-4H-124-triazol-3-yl)-2-(3-methylbenzoyl)-8-oxa-2-azaspiro[4.5]decane

SMILES

Cc1cccc(C(N(C2)CC3(CCOCC3)C2c2nncn2C2CC2)=O)c1

InChI

InChI=1S/C21H26N4O2/c1-15-3-2-4-16(11-15)20(26)24-12-18(21(13-24)7-9-27-10-8-21)19-23-22-14-25(19)17-5-6-17/h2-4,11,14,17-18H,5-10,12-13H2,1H3/t18-/m0/s1

InChI Key

VBVQOZHXSNDNBV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32257493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.819

Distribution Coefficient, logD

1.819

Water Solubility, LogSw

-2.10

Polar Surface Area

49.657

Acid Dissociation Constant (pKa)

19.34

Base Dissociation Constant (pKb)

4.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

References: we are preparing a list of scientific research reports with SC66-0372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC66-0372?
Check Price and Availability of SC66-0372, 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 SC66-0372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC66-0372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC66-0372
  • 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 SC66-0372 available by request