V001-3317 Screening compound: N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-2-[N-(2-methoxyethyl)ethanesulfonamido]acetamide

V001-3317 Screening compound: N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-2-[N-(2-methoxyethyl)ethanesulfonamido]acetamide
V001-3317 Screening compound: N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-2-[N-(2-methoxyethyl)ethanesulfonamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-3317
N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-2-[N-(2-methoxyethyl)ethanesulfonamido]acetamide

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

V001-3317

Molecular Formula

C26H33BrFN3O5S (C26 H33 BrFN3 O5 S)

Compound Name

N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-2-[N-(2-methoxyethyl)ethanesulfonamido]acetamide

IUPAC name

N-[1-(4-bromobenzoyl)piperidin-4-yl]-N-[(3-fluorophenyl)methyl]-2-[N-(2-methoxyethyl)ethanesulfonamido]acetamide

SMILES

CCS(N(CCOC)CC(N(Cc1cc(F)ccc1)C(CC1)CCN1C(c(cc1)ccc1Br)=O)=O)(=O)=O

InChI

InChI=1S/C26H33BrFN3O5S/c1-3-37(34,35)30(15-16-36-2)19-25(32)31(18-20-5-4-6-23(28)17-20)24-11-13-29(14-12-24)26(33)21-7-9-22(27)10-8-21/h4-10,17,24H,3,11-16,18-19H2,1-2H3

InChI Key

DOSGBOGWUVNAKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19970973

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

598.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.241

Distribution Coefficient, logD

3.241

Water Solubility, LogSw

-3.44

Polar Surface Area

71.485

Acid Dissociation Constant (pKa)

21.82

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

References: we are preparing a list of scientific research reports with V001-3317 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-3317?
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What is the minimum amount of V001-3317 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-3317
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-3317
  • 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 V001-3317 available by request