AM-807/12427078
TL;DR: AM-807/12427078 (CAS 494791-97-8) is a chemical compound with molecular formula C25H27N5O4 and molecular weight 461.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (8S)-6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate
Also Known As: AM-807/12427078, ethyl 6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-3,7,8,8a-tetrahydro-2(1H)-isoquinolinecarboxylate, ethyl (8S)-6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate, (8S)-ethyl 6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-1,7,8,8a-tetrahydroisoquinoline-2(3H)-carboxylate, ethyl (8S)-6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
| Molecular Formula | C25H27N5O4 |
|---|---|
| Molecular Weight | 461.21 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.2063 |
| Heavy Atoms | 34 |
| Complexity | 990.0 |
Chemical Identifiers
| CAS Number | 494791-97-8 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)[C@@H]2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(=O)OCC)OC |
| InChIKey | XBTMHDZBIOQLFU-AVKWCDSFSA-N |
Product Overview
AM-807/12427078 (CAS 494791-97-8), with molecular formula C25H27N5O4 and molecular weight 461.21 g/mol. IUPAC: ethyl (8S)-6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-2-carboxylate.
Chemical Property Profile of AM-807/12427078
Property Insights of AM-807/12427078
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AM-807/12427078. The TPSA of 145.0 Ų indicates high polarity, suggesting AM-807/12427078 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AM-807/12427078 has 1 hydrogen bond donor(s) and 8 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 AM-807/12427078?
The CAS number of AM-807/12427078 is 494791-97-8.
What is the molecular formula of AM-807/12427078?
The molecular formula of AM-807/12427078 is C25H27N5O4.
What is the molecular weight of AM-807/12427078?
The molecular weight of AM-807/12427078 is 461.21 g/mol.
Where can I buy AM-807/12427078?
You can request a quote for AM-807/12427078 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AM-807/12427078?
Yes, KEHONG BIO provides custom synthesis services for AM-807/12427078 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.