BAS 00083447
TL;DR: BAS 00083447 (CAS 300404-64-2) is a chemical compound with molecular formula C23H27N3OS and molecular weight 393.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,6-dimethylanilino)-1-(4-methoxyphenyl)-1,3-diazaspiro[4.5]dec-3-ene-2-thione
Also Known As: BAS 00083447, (Z)-4-((2,6-dimethylphenyl)imino)-1-(4-methoxyphenyl)-1,3-diazaspiro[4.5]decane-2-thione, 1-(2,6-dimethylanilino)-4-(4-methoxyphenyl)-2,4-diazaspiro[4.5]dec-1-ene-3-thione, (4Z)-4-[(2,6-dimethylphenyl)imino]-1-(4-methoxyphenyl)-1,3-diazaspiro[4.5]decane-2-thione
| Molecular Formula | C23H27N3OS |
|---|---|
| Molecular Weight | 393.19 g/mol |
| LogP | 5.63044 |
| Topological Polar Surface Area | 36.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.18747 |
| Heavy Atoms | 28 |
| Complexity | 893.6947 |
Chemical Identifiers
| CAS Number | 300404-64-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC2=NC(=S)N(C23CCCCC3)C4=CC=C(C=C4)OC |
Product Overview
BAS 00083447 (CAS 300404-64-2), with molecular formula C23H27N3OS and molecular weight 393.19 g/mol. IUPAC: 4-(2,6-dimethylanilino)-1-(4-methoxyphenyl)-1,3-diazaspiro[4.5]dec-3-ene-2-thione.
Chemical Property Profile of BAS 00083447
Property Insights of BAS 00083447
The XLogP value of 5.63044 indicates that BAS 00083447 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.86 Ų, BAS 00083447 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00083447 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00083447?
The CAS number of BAS 00083447 is 300404-64-2.
What is the molecular formula of BAS 00083447?
The molecular formula of BAS 00083447 is C23H27N3OS.
What is the molecular weight of BAS 00083447?
The molecular weight of BAS 00083447 is 393.19 g/mol.
Where can I buy BAS 00083447?
You can request a quote for BAS 00083447 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00083447?
Yes, KEHONG BIO provides custom synthesis services for BAS 00083447 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.