Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate
TL;DR: Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate (CAS 141931-33-1) is a chemical compound with molecular formula C17H24ClN2O3P and molecular weight 370.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
di(piperidin-1-yl)phosphoryl 3-chlorobenzoate
Also Known As: Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate, 1,3-Benzenediamine,diethyl-2-methyl, Bis(1-piperidyl)phosphoryl 3-chlorobenzoate, Benzoic acid,3-chloro-, anhydride with di-1-piperidinylphosphinic acid (9CI), [(3-Chlorobenzoyl)oxy]di(piperidin-1-yl)-lambda~5~-phosphanone
| Molecular Formula | C17H24ClN2O3P |
|---|---|
| Molecular Weight | 370.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.1213 |
| Heavy Atoms | 24 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 141931-33-1 |
|---|---|
| SMILES | C1CCN(CC1)P(=O)(N2CCCCC2)OC(=O)C3=CC(=CC=C3)Cl |
| InChIKey | ZIGQYQYOMYQNHV-UHFFFAOYSA-N |
Product Overview
Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate (CAS 141931-33-1), with molecular formula C17H24ClN2O3P and molecular weight 370.12 g/mol. IUPAC: di(piperidin-1-yl)phosphoryl 3-chlorobenzoate.
Chemical Property Profile of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate
Property Insights of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate
The XLogP value of 3.9 indicates that Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate?
The CAS number of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate is 141931-33-1.
What is the molecular formula of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate?
The molecular formula of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate is C17H24ClN2O3P.
What is the molecular weight of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate?
The molecular weight of Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate is 370.12 g/mol.
Where can I buy Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate?
You can request a quote for Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Di(piperidin-1-yl)phosphoryl 3-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.