AP-970/42837182
TL;DR: AP-970/42837182 (CAS 774552-99-7) is a chemical compound with molecular formula C22H23N5OS and molecular weight 405.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyltetrazol-5-yl)sulfanyl-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]ethanamine
Also Known As: AP-970/42837182, 2-(1-methyltetrazol-5-yl)sulfanyl-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]ethanamine, (2-Benzyloxy-naphthalen-1-ylmethyl)-[2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-ethyl]-amine, N-{[2-(benzyloxy)-1-naphthyl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)thio]ethanamine, N-{[2-(benzyloxy)naphthalen-1-yl]methyl}-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]ethanamine
| Molecular Formula | C22H23N5OS |
|---|---|
| Molecular Weight | 405.16 g/mol |
| LogP | 3.8242 |
| Topological Polar Surface Area | 64.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 405.16232 |
| Heavy Atoms | 29 |
| Complexity | 1067.1963 |
Chemical Identifiers
| CAS Number | 774552-99-7 |
|---|---|
| SMILES | CN1C(=NN=N1)SCCNCC2=C(C=CC3=CC=CC=C32)OCC4=CC=CC=C4 |
Product Overview
AP-970/42837182 (CAS 774552-99-7), with molecular formula C22H23N5OS and molecular weight 405.16 g/mol. IUPAC: 2-(1-methyltetrazol-5-yl)sulfanyl-N-[(2-phenylmethoxynaphthalen-1-yl)methyl]ethanamine.
Chemical Property Profile of AP-970/42837182
Property Insights of AP-970/42837182
The XLogP value of 3.8242 indicates that AP-970/42837182 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.86 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-970/42837182. Following Lipinski's Rule of Five, AP-970/42837182 has 1 hydrogen bond donor(s) and 6 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 AP-970/42837182?
The CAS number of AP-970/42837182 is 774552-99-7.
What is the molecular formula of AP-970/42837182?
The molecular formula of AP-970/42837182 is C22H23N5OS.
What is the molecular weight of AP-970/42837182?
The molecular weight of AP-970/42837182 is 405.16 g/mol.
Where can I buy AP-970/42837182?
You can request a quote for AP-970/42837182 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-970/42837182?
Yes, KEHONG BIO provides custom synthesis services for AP-970/42837182 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.