SC02-0102 Screening compound: N-[1-cyclohexyl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]-4-fluorobenzamide

SC02-0102 Screening compound: N-[1-cyclohexyl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]-4-fluorobenzamide
SC02-0102 Screening compound: N-[1-cyclohexyl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC02-0102
N-[1-cyclohexyl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]-4-fluorobenzamide

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

SC02-0102

Molecular Formula

C20H29FN2O2 (C20 H29 FN2 O2)

Compound Name

N-[1-cyclohexyl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]-4-fluorobenzamide

IUPAC name

N-[1-cyclohexyl-3-(2-methoxyethyl)pyrrolidin-3-yl]-4-fluorobenzamide

SMILES

COCCC(CC1)(CN1C1CCCCC1)NC(c(cc1)ccc1F)=O

InChI

InChI=1S/C20H29FN2O2/c1-25-14-12-20(22-19(24)16-7-9-17(21)10-8-16)11-13-23(15-20)18-5-3-2-4-6-18/h7-10,18H,2-6,11-15H2,1H3,(H,22,24)/t20-/m1/s1

InChI Key

ONLVMKHCZFWFIU-HXUWFJFHSA-N

MDL Number (MFCD)

MFCD32252170

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.245

Distribution Coefficient, logD

1.173

Water Solubility, LogSw

-3.43

Polar Surface Area

36.429

Acid Dissociation Constant (pKa)

12.96

Base Dissociation Constant (pKb)

9.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

65.00

SC02-0102 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CNS BBB Library (22607 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with SC02-0102 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC02-0102?
Check Price and Availability of SC02-0102, 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 SC02-0102 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC02-0102
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC02-0102
  • 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 SC02-0102 available by request