Methoxymethyl apovincaminate
TL;DR: Methoxymethyl apovincaminate (CAS 78101-34-5) is a chemical compound with molecular formula C22H26N2O3 and molecular weight 366.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methoxymethyl (15S,19S)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate
Also Known As: Methoxymethyl Apovincaminate, Methylenemethoxyapovincaminate, Eburnamenine-14-carboxylic acid, methoxymethyl ester, (3alpha,16alpha)-, Methoxymethyl 3alpha,16alpha-eburnamenine-14-carboxylate, 1H-Indolo(3,2,1-de)pyrido(3,2,1-ij)(1,5)-naphthyridine-12-carboxylic acid, 13a-ethyl-2,3,5,6,13a,13b-hexahydro-, methoxymethyl ester
| Molecular Formula | C22H26N2O3 |
|---|---|
| Molecular Weight | 366.19 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.19434 |
| Heavy Atoms | 27 |
| Complexity | 635.0 |
Chemical Identifiers
| CAS Number | 78101-34-5 |
|---|---|
| SMILES | CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4C(=C2)C(=O)OCOC |
| InChIKey | YFTYPMACWTZHPH-IRLDBZIGSA-N |
Product Overview
Methoxymethyl apovincaminate (CAS 78101-34-5), with molecular formula C22H26N2O3 and molecular weight 366.19 g/mol. IUPAC: methoxymethyl (15S,19S)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),16-pentaene-17-carboxylate.
Chemical Property Profile of Methoxymethyl apovincaminate
Property Insights of Methoxymethyl apovincaminate
The XLogP value of 3.7 indicates that Methoxymethyl apovincaminate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, Methoxymethyl apovincaminate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methoxymethyl apovincaminate 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 Methoxymethyl apovincaminate?
The CAS number of Methoxymethyl apovincaminate is 78101-34-5.
What is the molecular formula of Methoxymethyl apovincaminate?
The molecular formula of Methoxymethyl apovincaminate is C22H26N2O3.
What is the molecular weight of Methoxymethyl apovincaminate?
The molecular weight of Methoxymethyl apovincaminate is 366.19 g/mol.
Where can I buy Methoxymethyl apovincaminate?
You can request a quote for Methoxymethyl apovincaminate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methoxymethyl apovincaminate?
Yes, KEHONG BIO provides custom synthesis services for Methoxymethyl apovincaminate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.