F795-0090 Screening compound: N~1~-(2,6-dimethylphenyl)-2-[2,4-dioxo-3-phenethyl-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]acetamide

F795-0090 Screening compound: N~1~-(2,6-dimethylphenyl)-2-[2,4-dioxo-3-phenethyl-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
F795-0090 Screening compound: N~1~-(2,6-dimethylphenyl)-2-[2,4-dioxo-3-phenethyl-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F795-0090
N~1~-(2,6-dimethylphenyl)-2-[2,4-dioxo-3-phenethyl-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]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

F795-0090

Molecular Formula

C27H24N4O3S (C27 H24 N4 O3 S)

Compound Name

N~1~-(2,6-dimethylphenyl)-2-[2,4-dioxo-3-phenethyl-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]acetamide

IUPAC name

N-(26-dimethylphenyl)-2-[46-dioxo-5-(2-phenylethyl)-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)1012-tetraen-3-yl]acetamide

SMILES

Cc1cccc(C)c1NC(CN(c1c(C(N2CCc3ccccc3)=O)sc3ncccc13)C2=O)=O

InChI

InChI=1S/C27H24N4O3S/c1-17-8-6-9-18(2)22(17)29-21(32)16-31-23-20-12-7-14-28-25(20)35-24(23)26(33)30(27(31)34)15-13-19-10-4-3-5-11-19/h3-12,14H,13,15-16H2,1-2H3,(H,29,32)

InChI Key

NBIBUIUHVYIMQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27190857

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.658

Distribution Coefficient, logD

4.657

Water Solubility, LogSw

-4.27

Polar Surface Area

64.309

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with F795-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F795-0090?
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What is the minimum amount of F795-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F795-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F795-0090
  • 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 F795-0090 available by request