BAY-1433 free base
TL;DR: BAY-1433 free base (CAS 15421-87-1) is a chemical compound with molecular formula C18H29NO3 and molecular weight 307.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)propyl 2-hydroxy-3-methyl-2-phenylbutanoate
Also Known As: BAY-1433 free base, Mandelic acid, alpha-isopropyl-, 3-(diethylamino)propyl ester, 3-(diethylamino)propyl 2-hydroxy-3-methyl-2-phenylbutanoate, 3-(Diethylamino)propyl isopropyl(phenyl)glycolate hydrochloride, Benzeneacetic acid, alpha-hydroxy-alpha-(1-methylethyl)-, 3-(diethylamino)propyl ester
| Molecular Formula | C18H29NO3 |
|---|---|
| Molecular Weight | 307.21 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 307.21475 |
| Heavy Atoms | 22 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 15421-87-1 |
|---|---|
| SMILES | CCN(CC)CCCOC(=O)C(C1=CC=CC=C1)(C(C)C)O |
| InChIKey | UJPHMJMXYUUISU-UHFFFAOYSA-N |
Product Overview
BAY-1433 free base (CAS 15421-87-1), with molecular formula C18H29NO3 and molecular weight 307.21 g/mol. IUPAC: 3-(diethylamino)propyl 2-hydroxy-3-methyl-2-phenylbutanoate.
Chemical Property Profile of BAY-1433 free base
Property Insights of BAY-1433 free base
The XLogP value of 3.4 indicates that BAY-1433 free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, BAY-1433 free base exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAY-1433 free base has 1 hydrogen bond donor(s) and 4 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 BAY-1433 free base?
The CAS number of BAY-1433 free base is 15421-87-1.
What is the molecular formula of BAY-1433 free base?
The molecular formula of BAY-1433 free base is C18H29NO3.
What is the molecular weight of BAY-1433 free base?
The molecular weight of BAY-1433 free base is 307.21 g/mol.
Where can I buy BAY-1433 free base?
You can request a quote for BAY-1433 free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAY-1433 free base?
Yes, KEHONG BIO provides custom synthesis services for BAY-1433 free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.