T955-0978 Screening compound: 3-{3-[2-(cyclopentylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide
Chemical Structure Depiction of ChemDiv screening compound T955-0978
3-{3-[2-(cyclopentylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide
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
T955-0978
Molecular Formula
C18H30N4O3 (C18 H30 N4 O3)
Compound Name
3-{3-[2-(cyclopentylmethoxy)ethyl]-1,2,4-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide
IUPAC name
3-{3-[2-(cyclopentylmethoxy)ethyl]-124-oxadiazol-5-yl}-N-ethylpiperidine-1-carboxamide
SMILES
CCNC(N(CCC1)CC1c1nc(CCOCC2CCCC2)no1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
350.46
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
9.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
2.769
Distribution Coefficient, logD
2.769
Water Solubility, LogSw
-2.90
Polar Surface Area
68.168
Acid Dissociation Constant (pKa)
16.53
Base Dissociation Constant (pKb)
1.29
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
83.33
T955-0978 in Drug Discovery
Included in Screening Libraries
3D-Diversity Natural-Product-Like Library (18102 compounds)
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
Included in 1.7M Stock Database
- 3D
- Cyclic compounds
- PPI modulators
References: we are preparing a list of scientific research reports with T955-0978 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)