V009-4712 Screening compound: ethyl 1-[4-(2H-1,3-benzodioxole-5-amido)-2-[(1-phenylethyl)sulfamoyl]phenyl]piperidine-3-carboxylate

V009-4712 Screening compound: ethyl 1-[4-(2H-1,3-benzodioxole-5-amido)-2-[(1-phenylethyl)sulfamoyl]phenyl]piperidine-3-carboxylate
V009-4712 Screening compound: ethyl 1-[4-(2H-1,3-benzodioxole-5-amido)-2-[(1-phenylethyl)sulfamoyl]phenyl]piperidine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-4712
ethyl 1-[4-(2H-1,3-benzodioxole-5-amido)-2-[(1-phenylethyl)sulfamoyl]phenyl]piperidine-3-carboxylate

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

V009-4712

Molecular Formula

C30H33N3O7S (C30 H33 N3 O7 S)

Compound Name

ethyl 1-[4-(2H-1,3-benzodioxole-5-amido)-2-[(1-phenylethyl)sulfamoyl]phenyl]piperidine-3-carboxylate

IUPAC name

ethyl 1-[4-(2H-13-benzodioxole-5-amido)-2-[(1-phenylethyl)sulfamoyl]phenyl]piperidine-3-carboxylate

SMILES

CCOC(C(CCC1)CN1c(ccc(NC(c(cc1)cc2c1OCO2)=O)c1)c1S(NC(C)c1ccccc1)(=O)=O)=O

InChI

InChI=1S/C30H33N3O7S/c1-3-38-30(35)23-10-7-15-33(18-23)25-13-12-24(31-29(34)22-11-14-26-27(16-22)40-19-39-26)17-28(25)41(36,37)32-20(2)21-8-5-4-6-9-21/h4-6,8-9,11-14,16-17,20,23,32H,3,7,10,15,18-19H2,1-2H3,(H,31,34)

InChI Key

OGMHPEOPRMRSLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19972696

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

579.67

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.823

Distribution Coefficient, logD

4.821

Water Solubility, LogSw

-4.49

Polar Surface Area

105.419

Acid Dissociation Constant (pKa)

9.89

Base Dissociation Constant (pKb)

1.36

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with V009-4712 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-4712?
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What is the minimum amount of V009-4712 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-4712
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-4712
  • 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 V009-4712 available by request