![5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid structure](/static/products/1080/1080620-38-7.webp)
5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid
TL;DR: 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid (CAS 1080620-38-7) is a chemical compound with molecular formula C13H22N2O6S and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[3,4-bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid
Also Known As: BAS 00238842, 5-[3,4-bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid, 5-{3,4-Bis[(methoxycarbonyl)amino]tetrahydro-2-thienyl}pentanoic acid, 5-(3,4-Bis-methoxycarbonylamino-tetrahydro-thiophen-2-yl)-pentanoic acid, 5-[3,4-bis(methoxycarbonylamino)tetrahydrothiophen-2-yl]pentanoic acid
| Molecular Formula | C13H22N2O6S |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 1.196 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.11984 |
| Heavy Atoms | 22 |
| Complexity | 405.99155 |
Chemical Identifiers
| CAS Number | 1080620-38-7 |
|---|---|
| SMILES | COC(=O)NC1CSC(C1NC(=O)OC)CCCCC(=O)O |
Product Overview
5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid (CAS 1080620-38-7), with molecular formula C13H22N2O6S and molecular weight 334.12 g/mol. IUPAC: 5-[3,4-bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid.
Chemical Property Profile of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid
Property Insights of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid
The XLogP value of 1.196 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid. The TPSA of 113.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid. Following Lipinski's Rule of Five, 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid 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 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid?
The CAS number of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid is 1080620-38-7.
What is the molecular formula of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid?
The molecular formula of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid is C13H22N2O6S.
What is the molecular weight of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid?
The molecular weight of 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid is 334.12 g/mol.
Where can I buy 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid?
You can request a quote for 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[3,4-Bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.