V016-4310 Screening compound: 4-chloro-N-[2-({2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl}formamido)ethyl]butanamide

V016-4310 Screening compound: 4-chloro-N-[2-({2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl}formamido)ethyl]butanamide
V016-4310 Screening compound: 4-chloro-N-[2-({2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl}formamido)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-4310
4-chloro-N-[2-({2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl}formamido)ethyl]butanamide

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

V016-4310

Molecular Formula

C18H22ClN3O4S (C18 H22 ClN3 O4 S)

Compound Name

4-chloro-N-[2-({2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl}formamido)ethyl]butanamide

IUPAC name

4-chloro-N-[2-({2-[(2-methoxyphenoxy)methyl]-13-thiazol-4-yl}formamido)ethyl]butanamide

SMILES

COc(cccc1)c1OCc1nc(C(NCCNC(CCCCl)=O)=O)cs1

InChI

InChI=1S/C18H22ClN3O4S/c1-25-14-5-2-3-6-15(14)26-11-17-22-13(12-27-17)18(24)21-10-9-20-16(23)7-4-8-19/h2-3,5-6,12H,4,7-11H2,1H3,(H,20,23)(H,21,24)

InChI Key

HVHCELZUCZOCGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19968192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.465

Distribution Coefficient, logD

1.465

Water Solubility, LogSw

-2.23

Polar Surface Area

74.523

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

-1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

V016-4310 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with V016-4310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-4310?
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What is the minimum amount of V016-4310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-4310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-4310
  • 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 V016-4310 available by request