F795-0143 Screening compound: N~1~-ethyl-2-[3-(2-fluorophenyl)-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(3-methylphenyl)acetamide
Chemical Structure Depiction of ChemDiv screening compound F795-0143
N~1~-ethyl-2-[3-(2-fluorophenyl)-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(3-methylphenyl)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
F795-0143
Molecular Formula
C26H21FN4O3S (C26 H21 FN4 O3 S)
Compound Name
N~1~-ethyl-2-[3-(2-fluorophenyl)-2,4-dioxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-1(2H)-yl]-N~1~-(3-methylphenyl)acetamide
IUPAC name
N-ethyl-2-[5-(2-fluorophenyl)-46-dioxo-8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)1012-tetraen-3-yl]-N-(3-methylphenyl)acetamide
SMILES
CCN(C(CN(c1c(C(N2c(cccc3)c3F)=O)sc3ncccc13)C2=O)=O)c1cc(C)ccc1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
488.54
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
4.333
Distribution Coefficient, logD
4.333
Water Solubility, LogSw
-4.39
Polar Surface Area
56.756
Acid Dissociation Constant (pKa)
20.43
Base Dissociation Constant (pKb)
2.82
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
15.40
F795-0143 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein Arginine Methyltransferases Library (27925 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Digestive system
- Respiratory tract
- Male
- Female
- Hemic and lymphatic
- Metabolic
- Others
- Epigenetic
- Agro
References: we are preparing a list of scientific research reports with F795-0143 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)