D481-1819 Screening compound: 3-(4-methylphenyl)-1-(pyridine-2-carbonyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of ChemDiv screening compound D481-1819
3-(4-methylphenyl)-1-(pyridine-2-carbonyl)-1H-1,2,4-triazol-5-amine
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
D481-1819
Molecular Formula
C15H13N5O (C15 H13 N5 O)
Compound Name
3-(4-methylphenyl)-1-(pyridine-2-carbonyl)-1H-1,2,4-triazol-5-amine
IUPAC name
3-(4-methylphenyl)-1-(pyridine-2-carbonyl)-1H-124-triazol-5-amine
SMILES
Cc(cc1)ccc1-c1nn(C(c2ncccc2)=O)c(N)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
279.3
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
3.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
2.012
Distribution Coefficient, logD
2.012
Water Solubility, LogSw
-2.19
Polar Surface Area
66.895
Acid Dissociation Constant (pKa)
19.21
Base Dissociation Constant (pKb)
0.81
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
6.70
D481-1819 in Drug Discovery
Included in Screening Libraries
Anti-Aging Library (44940 compounds)
Fragments Library (11262 compounds)
Included in 1.7M Stock Database
- Cancer
- Musculoskeletal
- Metabolic
- Immune system
- Epigenetic
- Fragments
References: we are preparing a list of scientific research reports with D481-1819 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)