BM 113
TL;DR: BM 113 (CAS 13259-52-4) is a chemical compound with molecular formula C24H31NO3 and molecular weight 381.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
BM 113
ethyl 2-[1-(2-benzhydryloxyethyl)piperidin-4-yl]acetate
Also Known As: BM 113, 1-[2-(benzhydryloxy)ethyl]piperidine-4-acetic acid ethyl ester, ethyl 2-[1-(2-benzhydryloxyethyl)piperidin-4-yl]acetate, J1.153.676J, 1-(benzhydryloxyethyl)piperidino-4-ethylacetate
| Molecular Formula | C24H31NO3 |
|---|---|
| Molecular Weight | 381.23 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 381.2304 |
| Heavy Atoms | 28 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 13259-52-4 |
|---|---|
| SMILES | CCOC(=O)CC1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | LRPAEWGHKZNZQS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
BM 113 (CAS 13259-52-4), with molecular formula C24H31NO3 and molecular weight 381.23 g/mol. IUPAC: ethyl 2-[1-(2-benzhydryloxyethyl)piperidin-4-yl]acetate.
Chemical Property Profile of BM 113
Property Insights of BM 113
The XLogP value of 4.2 indicates that BM 113 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, BM 113 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BM 113 has 0 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 BM 113?
The CAS number of BM 113 is 13259-52-4.
What is the molecular formula of BM 113?
The molecular formula of BM 113 is C24H31NO3.
What is the molecular weight of BM 113?
The molecular weight of BM 113 is 381.23 g/mol.
Where can I buy BM 113?
You can request a quote for BM 113 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BM 113?
Yes, KEHONG BIO provides custom synthesis services for BM 113 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.