BAS 06900834
TL;DR: BAS 06900834 (CAS 1212487-47-2) is a chemical compound with molecular formula C24H27N5O2 and molecular weight 417.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,8aR)-6-amino-2-ethyl-8-(3-methoxy-4-propoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
Also Known As: BAS 06900834, AM-807/12740434, 6-amino-2-ethyl-8-(3-methoxy-4-propoxyphenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile, (8S,8aR)-6-amino-2-ethyl-8-(3-methoxy-4-propoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile, (8S,8aR)-6-amino-2-ethyl-8-(3-methoxy-4-propoxyphenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
| Molecular Formula | C24H27N5O2 |
|---|---|
| Molecular Weight | 417.22 g/mol |
| LogP | 3.22924 |
| Topological Polar Surface Area | 119.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.21646 |
| Heavy Atoms | 31 |
| Complexity | 1023.5201 |
Chemical Identifiers
| CAS Number | 1212487-47-2 |
|---|---|
| SMILES | CCCOC1=C(C=C(C=C1)[C@@H]2[C@H]3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)CC)OC |
Product Overview
BAS 06900834 (CAS 1212487-47-2), with molecular formula C24H27N5O2 and molecular weight 417.22 g/mol. IUPAC: (8S,8aR)-6-amino-2-ethyl-8-(3-methoxy-4-propoxyphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile.
Chemical Property Profile of BAS 06900834
Property Insights of BAS 06900834
The XLogP value of 3.22924 indicates that BAS 06900834 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06900834. Following Lipinski's Rule of Five, BAS 06900834 has 1 hydrogen bond donor(s) and 7 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 BAS 06900834?
The CAS number of BAS 06900834 is 1212487-47-2.
What is the molecular formula of BAS 06900834?
The molecular formula of BAS 06900834 is C24H27N5O2.
What is the molecular weight of BAS 06900834?
The molecular weight of BAS 06900834 is 417.22 g/mol.
Where can I buy BAS 06900834?
You can request a quote for BAS 06900834 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06900834?
Yes, KEHONG BIO provides custom synthesis services for BAS 06900834 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.