V022-3205 Screening compound: methyl 2-{[cyclopropyl(2-hydroxy-2-phenylethyl)amino]methyl}-5-ethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate

V022-3205 Screening compound: methyl 2-{[cyclopropyl(2-hydroxy-2-phenylethyl)amino]methyl}-5-ethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate
V022-3205 Screening compound: methyl 2-{[cyclopropyl(2-hydroxy-2-phenylethyl)amino]methyl}-5-ethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-3205
methyl 2-{[cyclopropyl(2-hydroxy-2-phenylethyl)amino]methyl}-5-ethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate

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

V022-3205

Molecular Formula

C22H25N3O4S (C22 H25 N3 O4 S)

Compound Name

methyl 2-{[cyclopropyl(2-hydroxy-2-phenylethyl)amino]methyl}-5-ethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxylate

IUPAC name

methyl 2-{[cyclopropyl(2-hydroxy-2-phenylethyl)amino]methyl}-5-ethyl-4-oxo-3H4H-thieno[23-d]pyrimidine-6-carboxylate

SMILES

CCc1c(C(OC)=O)sc(N=C(CN(CC(c2ccccc2)O)C2CC2)N2)c1C2=O

InChI

InChI=1S/C22H25N3O4S/c1-3-15-18-20(27)23-17(24-21(18)30-19(15)22(28)29-2)12-25(14-9-10-14)11-16(26)13-7-5-4-6-8-13/h4-8,14,16,26H,3,9-12H2,1-2H3,(H,23,24,27)/t16-/m0/s1

InChI Key

PLSATSYXQFQXIX-INIZCTEOSA-N

MDL Number (MFCD)

MFCD19873465

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

427.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.034

Distribution Coefficient, logD

3.032

Water Solubility, LogSw

-3.42

Polar Surface Area

75.308

Acid Dissociation Constant (pKa)

9.65

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

V022-3205 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V022-3205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-3205?
Check Price and Availability of V022-3205, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V022-3205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-3205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-3205
  • 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 V022-3205 available by request