N-Biotinylcaproylaminoethyl Methanethiosulfonate
TL;DR: N-Biotinylcaproylaminoethyl Methanethiosulfonate (CAS 353754-95-7) is a chemical compound with molecular formula C19H34N4O5S3 and molecular weight 494.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylsulfonylsulfanylethyl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide
Also Known As: N-Biotinylcaproylaminoethyl Methanethiosulfonate, N-(2-methylsulfonylsulfanylethyl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide
| Molecular Formula | C19H34N4O5S3 |
|---|---|
| Molecular Weight | 494.17 g/mol |
| LogP | 1.1978 |
| Topological Polar Surface Area | 133.47 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 15 |
| Exact Mass | 494.16913 |
| Heavy Atoms | 31 |
| Complexity | 719.3318 |
Chemical Identifiers
| CAS Number | 353754-95-7 |
|---|---|
| SMILES | CS(=O)(=O)SCCNC(=O)CCCCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2 |
Product Overview
N-Biotinylcaproylaminoethyl Methanethiosulfonate (CAS 353754-95-7), with molecular formula C19H34N4O5S3 and molecular weight 494.17 g/mol. IUPAC: N-(2-methylsulfonylsulfanylethyl)-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl)pentanoylamino]hexanamide.
Chemical Property Profile of N-Biotinylcaproylaminoethyl Methanethiosulfonate
Property Insights of N-Biotinylcaproylaminoethyl Methanethiosulfonate
The XLogP value of 1.1978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Biotinylcaproylaminoethyl Methanethiosulfonate. The TPSA of 133.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Biotinylcaproylaminoethyl Methanethiosulfonate. Following Lipinski's Rule of Five, N-Biotinylcaproylaminoethyl Methanethiosulfonate has 4 hydrogen bond donor(s) and 7 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 N-Biotinylcaproylaminoethyl Methanethiosulfonate?
The CAS number of N-Biotinylcaproylaminoethyl Methanethiosulfonate is 353754-95-7.
What is the molecular formula of N-Biotinylcaproylaminoethyl Methanethiosulfonate?
The molecular formula of N-Biotinylcaproylaminoethyl Methanethiosulfonate is C19H34N4O5S3.
What is the molecular weight of N-Biotinylcaproylaminoethyl Methanethiosulfonate?
The molecular weight of N-Biotinylcaproylaminoethyl Methanethiosulfonate is 494.17 g/mol.
Where can I buy N-Biotinylcaproylaminoethyl Methanethiosulfonate?
You can request a quote for N-Biotinylcaproylaminoethyl Methanethiosulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Biotinylcaproylaminoethyl Methanethiosulfonate?
Yes, KEHONG BIO provides custom synthesis services for N-Biotinylcaproylaminoethyl Methanethiosulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.