SC02-0156 Screening compound: 4-fluoro-N-(3-(2-methoxyethyl)-1-{[4-(methoxymethyl)-5-methyl-3-isoxazolyl]carbonyl}tetrahydro-1H-pyrrol-3-yl)benzamide

SC02-0156 Screening compound: 4-fluoro-N-(3-(2-methoxyethyl)-1-{[4-(methoxymethyl)-5-methyl-3-isoxazolyl]carbonyl}tetrahydro-1H-pyrrol-3-yl)benzamide
SC02-0156 Screening compound: 4-fluoro-N-(3-(2-methoxyethyl)-1-{[4-(methoxymethyl)-5-methyl-3-isoxazolyl]carbonyl}tetrahydro-1H-pyrrol-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC02-0156
4-fluoro-N-(3-(2-methoxyethyl)-1-{[4-(methoxymethyl)-5-methyl-3-isoxazolyl]carbonyl}tetrahydro-1H-pyrrol-3-yl)benzamide

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

SC02-0156

Molecular Formula

C21H26FN3O5 (C21 H26 FN3 O5)

Compound Name

4-fluoro-N-(3-(2-methoxyethyl)-1-{[4-(methoxymethyl)-5-methyl-3-isoxazolyl]carbonyl}tetrahydro-1H-pyrrol-3-yl)benzamide

IUPAC name

4-fluoro-N-[3-(2-methoxyethyl)-1-[4-(methoxymethyl)-5-methyl-12-oxazole-3-carbonyl]pyrrolidin-3-yl]benzamide

SMILES

Cc1c(COC)c(C(N(CC2)CC2(CCOC)NC(c(cc2)ccc2F)=O)=O)no1

InChI

InChI=1S/C21H26FN3O5/c1-14-17(12-29-3)18(24-30-14)20(27)25-10-8-21(13-25,9-11-28-2)23-19(26)15-4-6-16(22)7-5-15/h4-7H,8-13H2,1-3H3,(H,23,26)/t21-/m1/s1

InChI Key

SPUDRFOCQNOLMB-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD32252760

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.494

Distribution Coefficient, logD

1.494

Water Solubility, LogSw

-2.20

Polar Surface Area

80.448

Acid Dissociation Constant (pKa)

13.56

Base Dissociation Constant (pKb)

-1.42

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.62

SC02-0156 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC02-0156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC02-0156?
Check Price and Availability of SC02-0156, 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 SC02-0156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC02-0156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC02-0156
  • 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 SC02-0156 available by request