Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)
TL;DR: Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) (CAS 38953-40-1) is a chemical compound with molecular formula C26H31N5O3 and molecular weight 461.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzhydryloxy-1-methylpiperidine;1,3-dimethyl-7H-purine-2,6-dione
Also Known As: 4-(Diphenylmethoxy)-1-methylpiperidine 8-chlorotheophylline, Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1), 1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione- 4-(diphenylmethoxy)-1-methylpiperidine(1:1), 4-benzhydryloxy-1-methylpiperidine,1,3-dimethyl-7H-purine-2,, 4-benzhydryloxy-1-methylpiperidine,1,3-dimethyl-7H-purine-2,6-dione
| Molecular Formula | C26H31N5O3 |
|---|---|
| Molecular Weight | 461.24 g/mol |
| LogP | 2.8471 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 461.24268 |
| Heavy Atoms | 34 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 38953-40-1 |
|---|---|
| SMILES | CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3.CN1C2=C(C(=O)N(C1=O)C)NC=N2 |
| InChIKey | FCFDPVSGICFAKN-UHFFFAOYSA-N |
Product Overview
Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) (CAS 38953-40-1), with molecular formula C26H31N5O3 and molecular weight 461.24 g/mol. IUPAC: 4-benzhydryloxy-1-methylpiperidine;1,3-dimethyl-7H-purine-2,6-dione.
Chemical Property Profile of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)
Property Insights of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)
The XLogP value of 2.8471 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1). The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1). Following Lipinski's Rule of Five, Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) has 1 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 Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)?
The CAS number of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) is 38953-40-1.
What is the molecular formula of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)?
The molecular formula of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) is C26H31N5O3.
What is the molecular weight of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)?
The molecular weight of Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) is 461.24 g/mol.
Where can I buy Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)?
You can request a quote for Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 4-(diphenylmethoxy)-1-methyl-, 8-chlorotheophylline (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.