SC13-0077 Screening compound: N-[1-(3-methylpyridine-2-carbonyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide

SC13-0077 Screening compound: N-[1-(3-methylpyridine-2-carbonyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide
SC13-0077 Screening compound: N-[1-(3-methylpyridine-2-carbonyl)piperidin-3-yl]-N-[(pyridin-3-yl)methyl]cyclobutanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC13-0077
N-[1-(3-methylpyridine-2-carbonyl)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

SC13-0077

Molecular Formula

C23H28N4O2 (C23 H28 N4 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccnc1C(N(CCC1)CC1N(Cc1cnccc1)C(C1CCC1)=O)=O

InChI

InChI=1S/C23H28N4O2/c1-17-6-3-12-25-21(17)23(29)26-13-5-10-20(16-26)27(22(28)19-8-2-9-19)15-18-7-4-11-24-14-18/h3-4,6-7,11-12,14,19-20H,2,5,8-10,13,15-16H2,1H3/t20-/m0/s1

InChI Key

UMNPQMVWFLFJKL-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD32255374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.384

Distribution Coefficient, logD

1.384

Water Solubility, LogSw

-0.91

Polar Surface Area

51.671

Acid Dissociation Constant (pKa)

23.62

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.83

SC13-0077 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 SC13-0077 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC13-0077?
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What is the minimum amount of SC13-0077 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC13-0077
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC13-0077
  • 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 SC13-0077 available by request