Lenapenem hydrochloride monohydrate
TL;DR: Lenapenem hydrochloride monohydrate (CAS 149882-71-3) is a chemical compound with molecular formula C18H32ClN3O6S and molecular weight 453.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-3-[(3S,5S)-5-[(1R)-1-hydroxy-3-(methylamino)propyl]pyrrolidin-3-yl]sulfanyl-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid;hydrate;hydrochloride
Also Known As: Lenapenem hydrochloride hydrate, Hepatitis C Protease, lenapenem hydrochloride monohydrate, BO 2727, L 739428
| Molecular Formula | C18H32ClN3O6S |
|---|---|
| Molecular Weight | 453.17 g/mol |
| LogP | -0.8287 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.17004 |
| Heavy Atoms | 29 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 149882-71-3 |
|---|---|
| SMILES | C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1S[C@H]3C[C@H](NC3)[C@@H](CCNC)O)C(=O)O)[C@@H](C)O.O.Cl |
| InChIKey | FNSICOGCVDQJPU-HCRFUVGVSA-N |
Product Overview
Lenapenem hydrochloride monohydrate (CAS 149882-71-3), with molecular formula C18H32ClN3O6S and molecular weight 453.17 g/mol. IUPAC: (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-3-[(3S,5S)-5-[(1R)-1-hydroxy-3-(methylamino)propyl]pyrrolidin-3-yl]sulfanyl-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid;hydrate;hydrochloride.
Chemical Property Profile of Lenapenem hydrochloride monohydrate
Property Insights of Lenapenem hydrochloride monohydrate
The XLogP value of -0.8287 indicates that Lenapenem hydrochloride monohydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting Lenapenem hydrochloride monohydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lenapenem hydrochloride monohydrate has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lenapenem hydrochloride monohydrate?
The CAS number of Lenapenem hydrochloride monohydrate is 149882-71-3.
What is the molecular formula of Lenapenem hydrochloride monohydrate?
The molecular formula of Lenapenem hydrochloride monohydrate is C18H32ClN3O6S.
What is the molecular weight of Lenapenem hydrochloride monohydrate?
The molecular weight of Lenapenem hydrochloride monohydrate is 453.17 g/mol.
Where can I buy Lenapenem hydrochloride monohydrate?
You can request a quote for Lenapenem hydrochloride monohydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lenapenem hydrochloride monohydrate?
Yes, KEHONG BIO provides custom synthesis services for Lenapenem hydrochloride monohydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.