Pirlimycin Hydrochloride
TL;DR: Pirlimycin Hydrochloride (CAS 78822-40-9) is a chemical compound with molecular formula C17H32Cl2N2O5S and molecular weight 446.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-ethylpiperidine-2-carboxamide;hydrochloride
Also Known As: Pirlimycin Hydrochloride, Pirsue, Pirlimycin, Pirlimycin HCl, Pirlimycin (hydrochloride)
| Molecular Formula | C17H32Cl2N2O5S |
|---|---|
| Molecular Weight | 446.14 g/mol |
| LogP | 0.47 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.1409 |
| Heavy Atoms | 27 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 78822-40-9 |
|---|---|
| SMILES | CC[C@@H]1CCN[C@@H](C1)C(=O)N[C@@H]([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)[C@H](C)Cl.Cl |
| InChIKey | DPVJWUUBZWFDPG-XEDDUELXSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pirlimycin Hydrochloride (CAS 78822-40-9), with molecular formula C17H32Cl2N2O5S and molecular weight 446.14 g/mol. IUPAC: (2S,4R)-N-[(1S,2S)-2-chloro-1-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-methylsulfanyloxan-2-yl]propyl]-4-ethylpiperidine-2-carboxamide;hydrochloride.
Chemical Property Profile of Pirlimycin Hydrochloride
Property Insights of Pirlimycin Hydrochloride
The XLogP value of 0.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pirlimycin Hydrochloride. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Pirlimycin Hydrochloride. Following Lipinski's Rule of Five, Pirlimycin Hydrochloride has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pirlimycin Hydrochloride?
The CAS number of Pirlimycin Hydrochloride is 78822-40-9.
What is the molecular formula of Pirlimycin Hydrochloride?
The molecular formula of Pirlimycin Hydrochloride is C17H32Cl2N2O5S.
What is the molecular weight of Pirlimycin Hydrochloride?
The molecular weight of Pirlimycin Hydrochloride is 446.14 g/mol.
Where can I buy Pirlimycin Hydrochloride?
You can request a quote for Pirlimycin Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pirlimycin Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pirlimycin Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.