Y031-2507 Screening compound: 1-(4-methoxyphenyl)-5-oxo-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)pyrrolidine-3-carboxamide

Y031-2507 Screening compound: 1-(4-methoxyphenyl)-5-oxo-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)pyrrolidine-3-carboxamide
Y031-2507 Screening compound: 1-(4-methoxyphenyl)-5-oxo-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-2507
1-(4-methoxyphenyl)-5-oxo-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)pyrrolidine-3-carboxamide

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

Y031-2507

Molecular Formula

C23H27N3O6S (C23 H27 N3 O6 S)

Compound Name

1-(4-methoxyphenyl)-5-oxo-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)pyrrolidine-3-carboxamide

IUPAC name

1-(4-methoxyphenyl)-5-oxo-N-(4-{[(oxolan-2-yl)methyl]sulfamoyl}phenyl)pyrrolidine-3-carboxamide

SMILES

COc(cc1)ccc1N(CC(C1)C(Nc(cc2)ccc2S(NCC2OCCC2)(=O)=O)=O)C1=O

InChI

InChI=1S/C23H27N3O6S/c1-31-19-8-6-18(7-9-19)26-15-16(13-22(26)27)23(28)25-17-4-10-21(11-5-17)33(29,30)24-14-20-3-2-12-32-20/h4-11,16,20,24H,2-3,12-15H2,1H3,(H,25,28)

InChI Key

OCJMNVMJABSPJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07133159

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.570

Distribution Coefficient, logD

1.558

Water Solubility, LogSw

-2.54

Polar Surface Area

98.036

Acid Dissociation Constant (pKa)

8.95

Base Dissociation Constant (pKb)

-1.23

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.10

Y031-2507 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 Y031-2507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-2507?
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What is the minimum amount of Y031-2507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-2507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-2507
  • 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 Y031-2507 available by request