SC02-0092 Screening compound: 4-fluoro-N-[1-isobutyryl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]benzamide

SC02-0092 Screening compound: 4-fluoro-N-[1-isobutyryl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]benzamide
SC02-0092 Screening compound: 4-fluoro-N-[1-isobutyryl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SC02-0092
4-fluoro-N-[1-isobutyryl-3-(2-methoxyethyl)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

SC02-0092

Molecular Formula

C18H25FN2O3 (C18 H25 FN2 O3)

Compound Name

4-fluoro-N-[1-isobutyryl-3-(2-methoxyethyl)tetrahydro-1H-pyrrol-3-yl]benzamide

IUPAC name

4-fluoro-N-[3-(2-methoxyethyl)-1-(2-methylpropanoyl)pyrrolidin-3-yl]benzamide

SMILES

CC(C)C(N(CC1)CC1(CCOC)NC(c(cc1)ccc1F)=O)=O

InChI

InChI=1S/C18H25FN2O3/c1-13(2)17(23)21-10-8-18(12-21,9-11-24-3)20-16(22)14-4-6-15(19)7-5-14/h4-7,13H,8-12H2,1-3H3,(H,20,22)/t18-/m1/s1

InChI Key

PXDVZXQFPHOUIH-GOSISDBHSA-N

MDL Number (MFCD)

MFCD32252165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.057

Distribution Coefficient, logD

2.057

Water Solubility, LogSw

-2.76

Polar Surface Area

50.063

Acid Dissociation Constant (pKa)

13.62

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

References: we are preparing a list of scientific research reports with SC02-0092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC02-0092?
Check Price and Availability of SC02-0092, 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 SC02-0092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC02-0092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC02-0092
  • 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 SC02-0092 available by request