T499-1480 Screening compound: 1-[(5-bromothiophen-2-yl)sulfonyl]-3-{3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl}pyrrolidine
Chemical Structure Depiction of ChemDiv screening compound T499-1480
1-[(5-bromothiophen-2-yl)sulfonyl]-3-{3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl}pyrrolidine
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
T499-1480
Molecular Formula
C16H17BrN4O2S2 (C16 H17 BrN4 O2 S2)
Compound Name
1-[(5-bromothiophen-2-yl)sulfonyl]-3-{3-ethyl-3H-imidazo[4,5-b]pyridin-2-yl}pyrrolidine
IUPAC name
1-[(5-bromothiophen-2-yl)sulfonyl]-3-{3-ethyl-3H-imidazo[45-b]pyridin-2-yl}pyrrolidine
SMILES
CCn1c(nccc2)c2nc1C(CC1)CN1S(c(s1)ccc1Br)(=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
441.37
Hydrogen Bond Acceptors Count
7.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.400
Distribution Coefficient, logD
3.400
Water Solubility, LogSw
-3.37
Polar Surface Area
52.827
Acid Dissociation Constant (pKa)
21.59
Base Dissociation Constant (pKb)
3.81
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
37.50
T499-1480 in Drug Discovery
Included in Screening Libraries
Protein-Protein Interaction Library (218420 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
New Agro Library (44492 compounds)
Included in 1.7M Stock Database
- PPI modulators
- Cyclic compounds
- Agro
References: we are preparing a list of scientific research reports with T499-1480 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)