V028-1423 Screening compound: ethyl 2-({[4-(dimethylamino)-3-({N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}methyl)phenyl]carbamoyl}amino)acetate

V028-1423 Screening compound: ethyl 2-({[4-(dimethylamino)-3-({N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}methyl)phenyl]carbamoyl}amino)acetate
V028-1423 Screening compound: ethyl 2-({[4-(dimethylamino)-3-({N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}methyl)phenyl]carbamoyl}amino)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-1423
ethyl 2-({[4-(dimethylamino)-3-({N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}methyl)phenyl]carbamoyl}amino)acetate

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

V028-1423

Molecular Formula

C24H28N4O5S (C24 H28 N4 O5 S)

Compound Name

ethyl 2-({[4-(dimethylamino)-3-({N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}methyl)phenyl]carbamoyl}amino)acetate

IUPAC name

ethyl 2-({[4-(dimethylamino)-3-({N-[(furan-2-yl)methyl]-1-(thiophen-2-yl)formamido}methyl)phenyl]carbamoyl}amino)acetate

SMILES

CCOC(CNC(Nc(cc1)cc(CN(Cc2ccco2)C(c2cccs2)=O)c1N(C)C)=O)=O

InChI

InChI=1S/C24H28N4O5S/c1-4-32-22(29)14-25-24(31)26-18-9-10-20(27(2)3)17(13-18)15-28(16-19-7-5-11-33-19)23(30)21-8-6-12-34-21/h5-13H,4,14-16H2,1-3H3,(H2,25,26,31)

InChI Key

IMLGDSXJRZEOSK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19973421

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.789

Distribution Coefficient, logD

3.775

Water Solubility, LogSw

-3.91

Polar Surface Area

81.504

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

V028-1423 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V028-1423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-1423?
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What is the minimum amount of V028-1423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-1423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-1423
  • 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 V028-1423 available by request