Pilocarpine pamoate
TL;DR: Pilocarpine pamoate (CAS 63036-94-2) is a chemical compound with molecular formula C45H48N4O10 and molecular weight 804.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;bis((3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one)
Also Known As: Pilocarpine pamoate, DIPILOCARPINE PAMOATE, 2-Naphthalenecarboxylic acid, 4,4'-methylenebis(3-hydroxy-, compd. with (3S-cis)-3-ethyldihydro-4-((1-methyl-1H-imidazol-5-yl)methyl)-2(3H)-furanone (1:2), 2-NAPHTHALENECARBOXYLIC ACID, 4,4'-METHYLENEBIS(3-HYDROXY-, COMPD. WITH (3S-CIS)-3-ETHYLDIHYDRO-4((1-METHYL-1H-IMIDAZOL-5-YL)METHYL)-2(3H)-FURANONE (1:2), 4,4'-Methylenebis(3-hydroxynaphthalene-2-carboxylic acid)--(3S,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]oxolan-2-one (1/2)
| Molecular Formula | C45H48N4O10 |
|---|---|
| Molecular Weight | 804.34 g/mol |
| LogP | 6.715 |
| Topological Polar Surface Area | 203.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 804.33704 |
| Heavy Atoms | 59 |
| Complexity | 2334.1323 |
Chemical Identifiers
| CAS Number | 63036-94-2 |
|---|---|
| SMILES | CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C.CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O |
Product Overview
Pilocarpine pamoate (CAS 63036-94-2), with molecular formula C45H48N4O10 and molecular weight 804.34 g/mol. IUPAC: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;bis((3S,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]oxolan-2-one).
Chemical Property Profile of Pilocarpine pamoate
Property Insights of Pilocarpine pamoate
The XLogP value of 6.715 indicates that Pilocarpine pamoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 203.3 Ų indicates high polarity, suggesting Pilocarpine pamoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pilocarpine pamoate has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pilocarpine pamoate?
The CAS number of Pilocarpine pamoate is 63036-94-2.
What is the molecular formula of Pilocarpine pamoate?
The molecular formula of Pilocarpine pamoate is C45H48N4O10.
What is the molecular weight of Pilocarpine pamoate?
The molecular weight of Pilocarpine pamoate is 804.34 g/mol.
Where can I buy Pilocarpine pamoate?
You can request a quote for Pilocarpine pamoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pilocarpine pamoate?
Yes, KEHONG BIO provides custom synthesis services for Pilocarpine pamoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.