L127-0360 Screening compound: 2,5-dimethoxy-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide
Chemical Structure Depiction of ChemDiv screening compound L127-0360
2,5-dimethoxy-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide
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
L127-0360
Molecular Formula
C19H31N3O7S2 (C19 H31 N3 O7 S2)
Compound Name
2,5-dimethoxy-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide
IUPAC name
25-dimethoxy-N-[(oxolan-2-yl)methyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzene-1-sulfonamide
SMILES
COc(cc1)cc(S(N(CCS(N2CCNCC2)(=O)=O)CC2OCCC2)(=O)=O)c1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
CF3COOH
Molecular Weight
477.6
Hydrogen Bond Acceptors Count
14.00
Hydrogen Bond Donors Count
1.00
Rotatable Bond Count
10.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
-0.030
Distribution Coefficient, logD
-0.375
Water Solubility, LogSw
-2.24
Polar Surface Area
98.987
Acid Dissociation Constant (pKa)
22.14
Base Dissociation Constant (pKb)
7.48
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
68.40
L127-0360 in Drug Discovery
Included in Screening Libraries
3D-Pharmacophore Based Diversity Library (49813 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- Agro
References: we are preparing a list of scientific research reports with L127-0360 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)