V011-6801 Screening compound: 3-ethyl-1-(2-methoxyethyl)-1-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]urea

V011-6801 Screening compound: 3-ethyl-1-(2-methoxyethyl)-1-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]urea
V011-6801 Screening compound: 3-ethyl-1-(2-methoxyethyl)-1-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-6801
3-ethyl-1-(2-methoxyethyl)-1-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]urea

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

V011-6801

Molecular Formula

C25H35N3O4S (C25 H35 N3 O4 S)

Compound Name

3-ethyl-1-(2-methoxyethyl)-1-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl)ethyl]urea

IUPAC name

3-ethyl-1-(2-methoxyethyl)-1-[2-oxo-2-(4-{[4-(propan-2-yl)phenoxy]methyl}-4H5H6H7H-thieno[32-c]pyridin-5-yl)ethyl]urea

SMILES

CCNC(N(CCOC)CC(N(CC1)C(COc2ccc(C(C)C)cc2)c2c1scc2)=O)=O

InChI

InChI=1S/C25H35N3O4S/c1-5-26-25(30)27(13-14-31-4)16-24(29)28-12-10-23-21(11-15-33-23)22(28)17-32-20-8-6-19(7-9-20)18(2)3/h6-9,11,15,18,22H,5,10,12-14,16-17H2,1-4H3,(H,26,30)/t22-/m0/s1

InChI Key

SBRUSDQQQKQMPZ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19867304

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.222

Distribution Coefficient, logD

4.222

Water Solubility, LogSw

-3.97

Polar Surface Area

58.647

Acid Dissociation Constant (pKa)

16.64

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

V011-6801 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V011-6801 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-6801?
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What is the minimum amount of V011-6801 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-6801
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-6801
  • 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 V011-6801 available by request