D216-0210 Screening compound: 1-(butane-1-sulfonyl)-4-[4-(1H-1,2,3,4-tetrazol-1-yl)phenoxy]piperidine
Chemical Structure Depiction of ChemDiv screening compound D216-0210
1-(butane-1-sulfonyl)-4-[4-(1H-1,2,3,4-tetrazol-1-yl)phenoxy]piperidine
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
D216-0210
Molecular Formula
C16H23N5O3S (C16 H23 N5 O3 S)
Compound Name
1-(butane-1-sulfonyl)-4-[4-(1H-1,2,3,4-tetrazol-1-yl)phenoxy]piperidine
IUPAC name
1-(butane-1-sulfonyl)-4-[4-(1H-1234-tetrazol-1-yl)phenoxy]piperidine
SMILES
CCCCS(N(CC1)CCC1Oc(cc1)ccc1-n1nnnc1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
365.46
Hydrogen Bond Acceptors Count
9.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
7.00
Number of Nitrogen and Oxygen Atoms
8
Partition Coefficient, logP
2.324
Distribution Coefficient, logD
2.324
Water Solubility, LogSw
-2.65
Polar Surface Area
78.142
Acid Dissociation Constant (pKa)
22.19
Base Dissociation Constant (pKb)
-2.34
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
56.30
D216-0210 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
RAR (Nuclear receptors) Ligands Library (6524 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- Eye
- Cancer
- Respiratory tract
- Eye
- Male
- Female
- Hemic and lymphatic
- Congenital
- Skin
- Endocrine
- Immune system
- GPCR
- Ion Channels
- Nuclear receptors
- Receptor's ligands
- PPI modulators
- Receptor's ligands
- Cyclic compounds
References: we are preparing a list of scientific research reports with D216-0210 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)