2-(Dibenzylamino)butane-1,3-diol
TL;DR: 2-(Dibenzylamino)butane-1,3-diol (CAS 7462-46-6) is a chemical compound with molecular formula C18H23NO2 and molecular weight 285.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dibenzylamino)butane-1,3-diol
Also Known As: 2-(dibenzylamino)butane-1,3-diol
| Molecular Formula | C18H23NO2 |
|---|---|
| Molecular Weight | 285.17 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 285.17288 |
| Heavy Atoms | 21 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 7462-46-6 |
|---|---|
| SMILES | CC(C(CO)N(CC1=CC=CC=C1)CC2=CC=CC=C2)O |
| InChIKey | JRXPFTQCOQXAEU-UHFFFAOYSA-N |
Product Overview
2-(Dibenzylamino)butane-1,3-diol (CAS 7462-46-6), with molecular formula C18H23NO2 and molecular weight 285.17 g/mol. IUPAC: 2-(dibenzylamino)butane-1,3-diol.
Chemical Property Profile of 2-(Dibenzylamino)butane-1,3-diol
Property Insights of 2-(Dibenzylamino)butane-1,3-diol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dibenzylamino)butane-1,3-diol. With a topological polar surface area (TPSA) of 43.7 Ų, 2-(Dibenzylamino)butane-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dibenzylamino)butane-1,3-diol has 2 hydrogen bond donor(s) and 3 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 2-(Dibenzylamino)butane-1,3-diol?
The CAS number of 2-(Dibenzylamino)butane-1,3-diol is 7462-46-6.
What is the molecular formula of 2-(Dibenzylamino)butane-1,3-diol?
The molecular formula of 2-(Dibenzylamino)butane-1,3-diol is C18H23NO2.
What is the molecular weight of 2-(Dibenzylamino)butane-1,3-diol?
The molecular weight of 2-(Dibenzylamino)butane-1,3-diol is 285.17 g/mol.
Where can I buy 2-(Dibenzylamino)butane-1,3-diol?
You can request a quote for 2-(Dibenzylamino)butane-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dibenzylamino)butane-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dibenzylamino)butane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.