AB00674325-01
TL;DR: AB00674325-01 (CAS 1164529-69-4) is a chemical compound with molecular formula C17H17NO2S2 and molecular weight 331.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-hydroxyphenyl)-3,7-dithia-5-azatetracyclo[9.2.1.02,10.04,8]tetradec-4(8)-en-6-one
Also Known As: AB00674325-01, AF-399/42057251, 9-(4-hydroxyphenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methanothiochromeno[2,3-d]thiazol-2-one, F1422-0004, 9-(4-hydroxyphenyl)-3,4a,5,6,7,8,8a,9-octahydro-2H-5,8-methanothiochromeno[2,3-d][1,3]thiazol-2-one
| Molecular Formula | C17H17NO2S2 |
|---|---|
| Molecular Weight | 331.07 g/mol |
| LogP | 3.7943 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 331.07007 |
| Heavy Atoms | 22 |
| Complexity | 778.7018 |
Chemical Identifiers
| CAS Number | 1164529-69-4 |
|---|---|
| SMILES | C1CC2CC1C3C2SC4=C(C3C5=CC=C(C=C5)O)SC(=O)N4 |
Product Overview
AB00674325-01 (CAS 1164529-69-4), with molecular formula C17H17NO2S2 and molecular weight 331.07 g/mol. IUPAC: 9-(4-hydroxyphenyl)-3,7-dithia-5-azatetracyclo[9.2.1.02,10.04,8]tetradec-4(8)-en-6-one.
Chemical Property Profile of AB00674325-01
Property Insights of AB00674325-01
The XLogP value of 3.7943 indicates that AB00674325-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, AB00674325-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00674325-01 has 2 hydrogen bond donor(s) and 4 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 AB00674325-01?
The CAS number of AB00674325-01 is 1164529-69-4.
What is the molecular formula of AB00674325-01?
The molecular formula of AB00674325-01 is C17H17NO2S2.
What is the molecular weight of AB00674325-01?
The molecular weight of AB00674325-01 is 331.07 g/mol.
Where can I buy AB00674325-01?
You can request a quote for AB00674325-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00674325-01?
Yes, KEHONG BIO provides custom synthesis services for AB00674325-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.