BAS 06899810
TL;DR: BAS 06899810 (CAS 494792-26-6) is a chemical compound with molecular formula C23H25N5O2 and molecular weight 403.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,8aR)-6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
Also Known As: BAS 06899810, 6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydro-5,7,7(1H)-isoquinolinetricarbonitrile, AM-807/12740430, (8S,8aR)-6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile, (8S,8aR)-6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
| Molecular Formula | C23H25N5O2 |
|---|---|
| Molecular Weight | 403.20 g/mol |
| LogP | 2.83914 |
| Topological Polar Surface Area | 119.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.20084 |
| Heavy Atoms | 30 |
| Complexity | 985.24976 |
Chemical Identifiers
| CAS Number | 494792-26-6 |
|---|---|
| SMILES | CCCN1CC=C2[C@H](C1)[C@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC(=CC(=C3)OC)OC |
Product Overview
BAS 06899810 (CAS 494792-26-6), with molecular formula C23H25N5O2 and molecular weight 403.20 g/mol. IUPAC: (8S,8aR)-6-amino-8-(3,5-dimethoxyphenyl)-2-propyl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile.
Chemical Property Profile of BAS 06899810
Property Insights of BAS 06899810
The XLogP value of 2.83914 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06899810. The TPSA of 119.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06899810. Following Lipinski's Rule of Five, BAS 06899810 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 06899810?
The CAS number of BAS 06899810 is 494792-26-6.
What is the molecular formula of BAS 06899810?
The molecular formula of BAS 06899810 is C23H25N5O2.
What is the molecular weight of BAS 06899810?
The molecular weight of BAS 06899810 is 403.20 g/mol.
Where can I buy BAS 06899810?
You can request a quote for BAS 06899810 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06899810?
Yes, KEHONG BIO provides custom synthesis services for BAS 06899810 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.