D351-2807 Screening compound: 1-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]-2-methylpiperidine
Chemical Structure Depiction of ChemDiv screening compound D351-2807
1-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]-2-methylpiperidine
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
D351-2807
Molecular Formula
C22H23ClN4O2 (C22 H23 ClN4 O2)
Compound Name
1-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-carbonyl]-2-methylpiperidine
IUPAC name
1-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-1H-124-triazole-3-carbonyl]-2-methylpiperidine
SMILES
CC(CCCC1)N1C(c(nc1-c(cc2)ccc2OC)nn1-c(cccc1)c1Cl)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
410.9
Hydrogen Bond Acceptors Count
5.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
5.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
4.758
Distribution Coefficient, logD
4.758
Water Solubility, LogSw
-4.85
Polar Surface Area
47.065
Acid Dissociation Constant (pKa)
26.82
Base Dissociation Constant (pKb)
-3.06
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
31.80
D351-2807 in Drug Discovery
Included in Screening Libraries
Cardiovascular Library (22201 compounds)
Included in 1.7M Stock Database
- Cardiovascular
- Cancer
- Endocrine
- PPI modulators
References: we are preparing a list of scientific research reports with D351-2807 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)