C200-3465 Screening compound: 7-acetyl-3-(4-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

C200-3465 Screening compound: 7-acetyl-3-(4-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
C200-3465 Screening compound: 7-acetyl-3-(4-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-3465
7-acetyl-3-(4-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

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

C200-3465

Molecular Formula

C19H19N3O3S2 (C19 H19 N3 O3 S2)

Compound Name

7-acetyl-3-(4-methoxyphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

IUPAC name

11-acetyl-4-(4-methoxyphenyl)-5-(methylsulfanyl)-8-thia-4611-triazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)5-trien-3-one

SMILES

CC(N(CC1)Cc2c1c(C(N(c(cc1)ccc1OC)C(SC)=N1)=O)c1s2)=O

InChI

InChI=1S/C19H19N3O3S2/c1-11(23)21-9-8-14-15(10-21)27-17-16(14)18(24)22(19(20-17)26-3)12-4-6-13(25-2)7-5-12/h4-7H,8-10H2,1-3H3

InChI Key

RWRUEIXXQYHAEZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14726881

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.564

Distribution Coefficient, logD

2.564

Water Solubility, LogSw

-2.63

Polar Surface Area

49.927

Acid Dissociation Constant (pKa)

23.78

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

C200-3465 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C200-3465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-3465?
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What is the minimum amount of C200-3465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-3465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-3465
  • 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 C200-3465 available by request