D481-0381 Screening compound: N-[5,7-bis(4-methylphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-methylpropanamide
Chemical Structure Depiction of ChemDiv screening compound D481-0381
N-[5,7-bis(4-methylphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-methylpropanamide
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
D481-0381
Molecular Formula
C23H25N5O (C23 H25 N5 O)
Compound Name
N-[5,7-bis(4-methylphenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-methylpropanamide
IUPAC name
N-[57-bis(4-methylphenyl)-4H7H-[124]triazolo[15-a]pyrimidin-2-yl]-2-methylpropanamide
SMILES
CC(C)C(Nc1nn(C(C=C(c2ccc(C)cc2)N2)c3ccc(C)cc3)c2n1)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
387.48
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
5.331
Distribution Coefficient, logD
5.329
Water Solubility, LogSw
-5.37
Polar Surface Area
62.156
Acid Dissociation Constant (pKa)
9.84
Base Dissociation Constant (pKb)
-2.03
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
26.10
D481-0381 in Drug Discovery
Included in Screening Libraries
Anti-infective Library (19449 compounds)
Antiviral HBV Library (10007 compounds)
Antiviral Library (67538 compounds)
Protein-Protein Interaction Library (218420 compounds)
Adenosine Receptors Targeted Library (19896 compounds)
Included in 1.7M Stock Database
- Infections
- Immune system
- animal
- Antiviral
- Infections
- Immune system
- Antiviral
- Infections
- Immune system
- Cancer
- Digestive system
- Respiratory tract
- Nervous system
- Eye
- Cardiovascular
- PPI modulators
- Receptor's ligands
- GPCR
References: we are preparing a list of scientific research reports with D481-0381 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)