SC66-0316 Screening compound: 4-(4-isobutyl-4H-1,2,4-triazol-3-yl)-N~2~-(2-methoxyethyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

SC66-0316 Screening compound: 4-(4-isobutyl-4H-1,2,4-triazol-3-yl)-N~2~-(2-methoxyethyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide
SC66-0316 Screening compound: 4-(4-isobutyl-4H-1,2,4-triazol-3-yl)-N~2~-(2-methoxyethyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC66-0316
4-(4-isobutyl-4H-1,2,4-triazol-3-yl)-N~2~-(2-methoxyethyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

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

SC66-0316

Molecular Formula

C18H31N5O3 (C18 H31 N5 O3)

Compound Name

4-(4-isobutyl-4H-1,2,4-triazol-3-yl)-N~2~-(2-methoxyethyl)-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

IUPAC name

N-(2-methoxyethyl)-4-[4-(2-methylpropyl)-4H-124-triazol-3-yl]-8-oxa-2-azaspiro[4.5]decane-2-carboxamide

SMILES

CC(C)Cn1c(C(CN(C2)C(NCCOC)=O)C22CCOCC2)nnc1

InChI

InChI=1S/C18H31N5O3/c1-14(2)10-23-13-20-21-16(23)15-11-22(17(24)19-6-9-25-3)12-18(15)4-7-26-8-5-18/h13-15H,4-12H2,1-3H3,(H,19,24)/t15-/m0/s1

InChI Key

GEUWRJMNCJMLJU-HNNXBMFYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.035

Distribution Coefficient, logD

1.035

Water Solubility, LogSw

-1.63

Polar Surface Area

67.903

Acid Dissociation Constant (pKa)

15.87

Base Dissociation Constant (pKb)

4.03

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

83.33

SC66-0316 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with SC66-0316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC66-0316?
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What is the minimum amount of SC66-0316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC66-0316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC66-0316
  • 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 SC66-0316 available by request