SB95-0035 Screening compound: 3,4-difluoro-N-(2-piperidinoethyl)-N-(3-piperidyl)benzamide
Chemical Structure Depiction of ChemDiv screening compound SB95-0035
3,4-difluoro-N-(2-piperidinoethyl)-N-(3-piperidyl)benzamide
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
SB95-0035
Molecular Formula
C19H27F2N3O (C19 H27 F2 N3 O)
Compound Name
3,4-difluoro-N-(2-piperidinoethyl)-N-(3-piperidyl)benzamide
IUPAC name
34-difluoro-N-[2-(piperidin-1-yl)ethyl]-N-(piperidin-3-yl)benzamide
SMILES
O=C(c(cc1)cc(F)c1F)N(CCN1CCCCC1)C1CNCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
HCl
Molecular Weight
351.44
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
4
Partition Coefficient, logP
1.906
Distribution Coefficient, logD
0.881
Water Solubility, LogSw
-2.46
Polar Surface Area
31.275
Acid Dissociation Constant (pKa)
26.43
Base Dissociation Constant (pKb)
8.38
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
63.16
SB95-0035 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with SB95-0035 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)