Spiraprilat
TL;DR: Spiraprilat (CAS 83507-88-4) is a chemical compound with molecular formula C20H26N2O5S2 and molecular weight 438.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S)-7-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid
Also Known As: SPIRAPRILAT, Spiraprilate, Spiraprilatum, Spirapril diacid, Espiraprilat
| Molecular Formula | C20H26N2O5S2 |
|---|---|
| Molecular Weight | 438.13 g/mol |
| LogP | 1.9123 |
| Topological Polar Surface Area | 106.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 438.12833 |
| Heavy Atoms | 29 |
| Complexity | 754.4983 |
Chemical Identifiers
| CAS Number | 83507-88-4 |
|---|---|
| SMILES | C[C@@H](C(=O)N1CC2(C[C@H]1C(=O)O)SCCS2)N[C@@H](CCC3=CC=CC=C3)C(=O)O |
Product Overview
Spiraprilat (CAS 83507-88-4), with molecular formula C20H26N2O5S2 and molecular weight 438.13 g/mol. IUPAC: (8S)-7-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]propanoyl]-1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid.
Chemical Property Profile of Spiraprilat
Property Insights of Spiraprilat
The XLogP value of 1.9123 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiraprilat. The TPSA of 106.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Spiraprilat. Following Lipinski's Rule of Five, Spiraprilat has 3 hydrogen bond donor(s) and 6 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 Spiraprilat?
The CAS number of Spiraprilat is 83507-88-4.
What is the molecular formula of Spiraprilat?
The molecular formula of Spiraprilat is C20H26N2O5S2.
What is the molecular weight of Spiraprilat?
The molecular weight of Spiraprilat is 438.13 g/mol.
Where can I buy Spiraprilat?
You can request a quote for Spiraprilat directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiraprilat?
Yes, KEHONG BIO provides custom synthesis services for Spiraprilat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.