F463-0001 Screening compound: N~4~-(2-furylmethyl)-1-pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl-4-piperidinecarboxamide
Chemical Structure Depiction of ChemDiv screening compound F463-0001
N~4~-(2-furylmethyl)-1-pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl-4-piperidinecarboxamide
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
F463-0001
Molecular Formula
C20H19N5O2S (C20 H19 N5 O2 S)
Compound Name
N~4~-(2-furylmethyl)-1-pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl-4-piperidinecarboxamide
IUPAC name
N-[(furan-2-yl)methyl]-1-{8-thia-3510-triazatricyclo[7.4.0.0^{27}]trideca-1(13)2(7)35911-hexaen-6-yl}piperidine-4-carboxamide
SMILES
O=C(C(CC1)CCN1c1c2sc3ncccc3c2ncn1)NCc1ccco1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
393.47
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
3.219
Distribution Coefficient, logD
3.187
Water Solubility, LogSw
-3.11
Polar Surface Area
66.234
Acid Dissociation Constant (pKa)
12.38
Base Dissociation Constant (pKb)
6.27
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
30.00
F463-0001 in Drug Discovery
Included in Screening Libraries
GPCR Targeted Library (31838 compounds)
Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)
Included in 1.7M Stock Database
- Musculoskeletal
- Respiratory tract
- Nervous system
- Congenital
- Skin
- Metabolic
- Endocrine
- Cancer
- Digestive system
- Female
- Hemic and lymphatic
- Metabolic
- Immune system
- GPCR
- Others
- Receptor's ligands
References: we are preparing a list of scientific research reports with F463-0001 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)