L461-0276 Screening compound: 1-(4-methylbenzenesulfonyl)-4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepane
Chemical Structure Depiction of ChemDiv screening compound L461-0276
1-(4-methylbenzenesulfonyl)-4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepane
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
L461-0276
Molecular Formula
C18H20N4O2S2 (C18 H20 N4 O2 S2)
Compound Name
1-(4-methylbenzenesulfonyl)-4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepane
IUPAC name
1-(4-methylbenzenesulfonyl)-4-{[13]thiazolo[54-b]pyridin-2-yl}-14-diazepane
SMILES
Cc(cc1)ccc1S(N(CCC1)CCN1c1nc(cccn2)c2s1)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
388.51
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.608
Distribution Coefficient, logD
3.608
Water Solubility, LogSw
-3.57
Polar Surface Area
54.482
Acid Dissociation Constant (pKa)
22.60
Base Dissociation Constant (pKb)
3.84
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
33.30
L461-0276 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Targeted Diversity Library (40567 compounds)
Recognition Elements PPI Library (24135 compounds)
Included in 1.7M Stock Database
- PPI modulators
- PPI modulators
- Mimetics
References: we are preparing a list of scientific research reports with L461-0276 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)