AEM1 derivative, 1
TL;DR: AEM1 derivative, 1 (CAS 1005095-05-5) is a chemical compound with molecular formula C25H30N2O2 and molecular weight 390.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxypropyl)-10-phenyl-9-azatetracyclo[10.2.1.02,11.03,8]pentadeca-3(8),4,6-triene-5-carboxamide
Also Known As: AEM1 derivative, 1, N-(3-Methoxypropyl)-6-phenyl-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-2-carboxamide, BAS 06163246, (Z)-N-(3-methoxypropyl)-10-phenyl-9-azatetracyclo[10.2.1.0(2),(1)(1).0(3),?]pentadeca-3(8),4,6-triene-5-carboximidic acid, N-(3-methoxypropyl)-10-phenyl-9-azatetracyclo[10.2.1.0(2),(1)(1).0(3),?]pentadeca-3(8),4,6-triene-5-carboxamide
| Molecular Formula | C25H30N2O2 |
|---|---|
| Molecular Weight | 390.23 g/mol |
| LogP | 4.7494 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.23074 |
| Heavy Atoms | 29 |
| Complexity | 881.64703 |
Chemical Identifiers
| CAS Number | 1005095-05-5 |
|---|---|
| SMILES | COCCCNC(=O)C1=CC2=C(C=C1)NC(C3C2C4CCC3C4)C5=CC=CC=C5 |
Product Overview
AEM1 derivative, 1 (CAS 1005095-05-5), with molecular formula C25H30N2O2 and molecular weight 390.23 g/mol. IUPAC: N-(3-methoxypropyl)-10-phenyl-9-azatetracyclo[10.2.1.02,11.03,8]pentadeca-3(8),4,6-triene-5-carboxamide.
Chemical Property Profile of AEM1 derivative, 1
Property Insights of AEM1 derivative, 1
The XLogP value of 4.7494 indicates that AEM1 derivative, 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, AEM1 derivative, 1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AEM1 derivative, 1 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 AEM1 derivative, 1?
The CAS number of AEM1 derivative, 1 is 1005095-05-5.
What is the molecular formula of AEM1 derivative, 1?
The molecular formula of AEM1 derivative, 1 is C25H30N2O2.
What is the molecular weight of AEM1 derivative, 1?
The molecular weight of AEM1 derivative, 1 is 390.23 g/mol.
Where can I buy AEM1 derivative, 1?
You can request a quote for AEM1 derivative, 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AEM1 derivative, 1?
Yes, KEHONG BIO provides custom synthesis services for AEM1 derivative, 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.