T482-1164 Screening compound: 1-(4-methylphenyl)-3-[2-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-8-yl]urea
Chemical Structure Depiction of ChemDiv screening compound T482-1164
1-(4-methylphenyl)-3-[2-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-8-yl]urea
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
T482-1164
Molecular Formula
C17H19N5O (C17 H19 N5 O)
Compound Name
1-(4-methylphenyl)-3-[2-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-8-yl]urea
IUPAC name
1-(4-methylphenyl)-3-[2-(propan-2-yl)-[124]triazolo[15-a]pyridin-8-yl]urea
SMILES
CC(C)c1nn(cccc2NC(Nc3ccc(C)cc3)=O)c2n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
309.37
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
3.496
Distribution Coefficient, logD
3.496
Water Solubility, LogSw
-3.51
Polar Surface Area
53.532
Acid Dissociation Constant (pKa)
11.31
Base Dissociation Constant (pKb)
2.29
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
23.50
T482-1164 in Drug Discovery
Included in Screening Libraries
Anticancer Library (62698 compounds)
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
C-Met Library (15277 compounds)
SmartTM Library (51161 compounds)
Included in 1.7M Stock Database
- Cancer
- Cancer
- Digestive system
- Respiratory tract
- Otorhinolaryngologic
- Endocrine
- Kinases
- Receptor's ligands
References: we are preparing a list of scientific research reports with T482-1164 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)