V001-1309 Screening compound: 2-{butyl[(3,4-dichlorophenyl)carbamoyl]amino}-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(thiophen-2-yl)methyl]acetamide

V001-1309 Screening compound: 2-{butyl[(3,4-dichlorophenyl)carbamoyl]amino}-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(thiophen-2-yl)methyl]acetamide
V001-1309 Screening compound: 2-{butyl[(3,4-dichlorophenyl)carbamoyl]amino}-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(thiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-1309
2-{butyl[(3,4-dichlorophenyl)carbamoyl]amino}-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(thiophen-2-yl)methyl]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

V001-1309

Molecular Formula

C28H33Cl2N3O4S (C28 H33 Cl2 N3 O4 S)

Compound Name

2-{butyl[(3,4-dichlorophenyl)carbamoyl]amino}-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

2-{butyl[(34-dichlorophenyl)carbamoyl]amino}-N-[2-(34-dimethoxyphenyl)ethyl]-N-[(thiophen-2-yl)methyl]acetamide

SMILES

CCCCN(CC(N(CCc(cc1)cc(OC)c1OC)Cc1cccs1)=O)C(Nc(cc1)cc(Cl)c1Cl)=O

InChI

InChI=1S/C28H33Cl2N3O4S/c1-4-5-13-33(28(35)31-21-9-10-23(29)24(30)17-21)19-27(34)32(18-22-7-6-15-38-22)14-12-20-8-11-25(36-2)26(16-20)37-3/h6-11,15-17H,4-5,12-14,18-19H2,1-3H3,(H,31,35)

InChI Key

WMKNBPLXLKOMOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19755842

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

578.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.343

Distribution Coefficient, logD

6.342

Water Solubility, LogSw

-6.15

Polar Surface Area

57.190

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V001-1309 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-1309?
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What is the minimum amount of V001-1309 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-1309
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-1309
  • 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 V001-1309 available by request