P970-0007 Screening compound: N~3~-(tetrahydro-2H-pyran-4-ylmethyl)-3-furamide
Chemical Structure Depiction of ChemDiv screening compound P970-0007
N~3~-(tetrahydro-2H-pyran-4-ylmethyl)-3-furamide
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
P970-0007
Molecular Formula
C11H15NO3 (C11 H15 NO3)
Compound Name
N~3~-(tetrahydro-2H-pyran-4-ylmethyl)-3-furamide
IUPAC name
N-[(oxan-4-yl)methyl]furan-3-carboxamide
SMILES
O=C(c1cocc1)NCC1CCOCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
209.25
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.112
Distribution Coefficient, logD
1.112
Water Solubility, LogSw
-1.76
Polar Surface Area
40.556
Acid Dissociation Constant (pKa)
14.27
Base Dissociation Constant (pKb)
-1.15
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
54.54
P970-0007 in Drug Discovery
Included in Screening Libraries
3D-Fragment Library (4274 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Protein-Protein Interaction Library (218420 compounds)
Soluble Diversity Library (15920 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- 3D
- Fragments
- Cyclic compounds
- PPI modulators
References: we are preparing a list of scientific research reports with P970-0007 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)