SC13-0076 Screening compound: N-[1-(2-cyclopropylacetyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide

SC13-0076 Screening compound: N-[1-(2-cyclopropylacetyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide
SC13-0076 Screening compound: N-[1-(2-cyclopropylacetyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC13-0076
N-[1-(2-cyclopropylacetyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide

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

SC13-0076

Molecular Formula

C21H29N3O2 (C21 H29 N3 O2)

Compound Name

N-[1-(2-cyclopropylacetyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide

IUPAC name

N-[1-(2-cyclopropylacetyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide

SMILES

O=C(CC1CC1)N(CCC1)CC1N(Cc1cnccc1)C(C1CCC1)=O

InChI

InChI=1S/C21H29N3O2/c25-20(12-16-8-9-16)23-11-3-7-19(15-23)24(21(26)18-5-1-6-18)14-17-4-2-10-22-13-17/h2,4,10,13,16,18-19H,1,3,5-9,11-12,14-15H2/t19-/m0/s1

InChI Key

NUKQYSULNNYJMM-IBGZPJMESA-N

MDL Number (MFCD)

MFCD32255373

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.302

Distribution Coefficient, logD

1.301

Water Solubility, LogSw

-0.99

Polar Surface Area

41.849

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

66.67

SC13-0076 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC13-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC13-0076?
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What is the minimum amount of SC13-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC13-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC13-0076
  • 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 SC13-0076 available by request