SC01-0018 Screening compound: N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N,3-dimethylbenzamide

SC01-0018 Screening compound: N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N,3-dimethylbenzamide
SC01-0018 Screening compound: N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N,3-dimethylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC01-0018
N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N,3-dimethylbenzamide

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

SC01-0018

Molecular Formula

C21H25N5O3 (C21 H25 N5 O3)

Compound Name

N-{2-[5-(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)-1,2,4-oxadiazol-3-yl]ethyl}-N,3-dimethylbenzamide

IUPAC name

N-[2-(5-{1-ethyl-1H4H6H7H-pyrano[43-c]pyrazol-3-yl}-124-oxadiazol-3-yl)ethyl]-N3-dimethylbenzamide

SMILES

CCn(c1c2COCC1)nc2-c1nc(CCN(C)C(c2cc(C)ccc2)=O)no1

InChI

InChI=1S/C21H25N5O3/c1-4-26-17-9-11-28-13-16(17)19(23-26)20-22-18(24-29-20)8-10-25(3)21(27)15-7-5-6-14(2)12-15/h5-7,12H,4,8-11,13H2,1-3H3

InChI Key

AYJBLDHLWRUVNG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32251072

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.610

Distribution Coefficient, logD

1.610

Water Solubility, LogSw

-1.87

Polar Surface Area

71.819

Acid Dissociation Constant (pKa)

22.21

Base Dissociation Constant (pKb)

0.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.86

References: we are preparing a list of scientific research reports with SC01-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of SC01-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC01-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC01-0018
  • 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 SC01-0018 available by request