1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride
TL;DR: 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride (CAS 2990-22-9) is a chemical compound with molecular formula C15H26ClNO6S2 and molecular weight 415.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[benzyl(3-methylsulfonyloxypropyl)amino]propyl methanesulfonate;hydrochloride
Also Known As: 3,3'-Dimesyloxy-N-benzyldipropylamine hydrochloride, 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride, 3,3'-(Benzylimino)di-1-propanol dimethanesulfonate (ester) hydrochloride, (Benzylazanediyl)di(propane-3,1-diyl) dimethanesulfonate--hydrogen chloride (1/1), 3-[benzyl(3-methylsulfonyloxypropyl)amino]propyl methanesulfonate hydrochloride
| Molecular Formula | C15H26ClNO6S2 |
|---|---|
| Molecular Weight | 415.09 g/mol |
| LogP | 1.643 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 415.08902 |
| Heavy Atoms | 25 |
| Complexity | 489.0 |
Chemical Identifiers
| CAS Number | 2990-22-9 |
|---|---|
| SMILES | CS(=O)(=O)OCCCN(CCCOS(=O)(=O)C)CC1=CC=CC=C1.Cl |
| InChIKey | BGWVHHATXPCFNA-UHFFFAOYSA-N |
Product Overview
1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride (CAS 2990-22-9), with molecular formula C15H26ClNO6S2 and molecular weight 415.09 g/mol. IUPAC: 3-[benzyl(3-methylsulfonyloxypropyl)amino]propyl methanesulfonate;hydrochloride.
Chemical Property Profile of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride
Property Insights of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride
The XLogP value of 1.643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride. Following Lipinski's Rule of Five, 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride has 1 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 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride?
The CAS number of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride is 2990-22-9.
What is the molecular formula of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride?
The molecular formula of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride is C15H26ClNO6S2.
What is the molecular weight of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride?
The molecular weight of 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride is 415.09 g/mol.
Where can I buy 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride?
You can request a quote for 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanol, 3,3'-(benzylimino)di-, dimethanesulfonate (ester), hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.