L303-3196 Screening compound: 1-{4-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]benzenesulfonyl}-4-(pyrrolidine-1-carbonyl)piperidine
Chemical Structure Depiction of ChemDiv screening compound L303-3196
1-{4-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]benzenesulfonyl}-4-(pyrrolidine-1-carbonyl)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
L303-3196
Molecular Formula
C25H26N4O6S (C25 H26 N4 O6 S)
Compound Name
1-{4-[5-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-3-yl]benzenesulfonyl}-4-(pyrrolidine-1-carbonyl)piperidine
IUPAC name
1-{4-[5-(2H-13-benzodioxol-5-yl)-124-oxadiazol-3-yl]benzenesulfonyl}-4-(pyrrolidine-1-carbonyl)piperidine
SMILES
O=C(C(CC1)CCN1S(c(cc1)ccc1-c1noc(-c(cc2)cc3c2OCO3)n1)(=O)=O)N1CCCC1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
510.57
Hydrogen Bond Acceptors Count
12.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
6.00
Number of Nitrogen and Oxygen Atoms
10
Partition Coefficient, logP
3.997
Distribution Coefficient, logD
3.997
Water Solubility, LogSw
-4.20
Polar Surface Area
97.485
Acid Dissociation Constant (pKa)
23.63
Base Dissociation Constant (pKb)
-1.28
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
40.00
L303-3196 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Macl-GPIb alpha Interaction Library (22969 compounds)
Targeted Diversity Library (40567 compounds)
Included in 1.7M Stock Database
- Hemic and lymphatic
- Cardiovascular
References: we are preparing a list of scientific research reports with L303-3196 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)