AB00332344-11
TL;DR: AB00332344-11 (CAS 618396-98-8) is a chemical compound with molecular formula C17H15BrN2O3S and molecular weight 406.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-5,5-dioxo-1-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one
Also Known As: AB00332344-11, AF-399/41981398, 1-(4-bromophenyl)-3-phenyltetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one 5,5-dioxide, 3-(4-bromophenyl)-5,5-dioxo-1-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one
| Molecular Formula | C17H15BrN2O3S |
|---|---|
| Molecular Weight | 406.00 g/mol |
| LogP | 3.0613 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.9987 |
| Heavy Atoms | 24 |
| Complexity | 883.81146 |
Chemical Identifiers
| CAS Number | 618396-98-8 |
|---|---|
| SMILES | C1C2C(CS1(=O)=O)N(C(=O)N2C3=CC=CC=C3)C4=CC=C(C=C4)Br |
Product Overview
AB00332344-11 (CAS 618396-98-8), with molecular formula C17H15BrN2O3S and molecular weight 406.00 g/mol. IUPAC: 3-(4-bromophenyl)-5,5-dioxo-1-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one.
Chemical Property Profile of AB00332344-11
Property Insights of AB00332344-11
The XLogP value of 3.0613 indicates that AB00332344-11 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, AB00332344-11 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00332344-11 has 0 hydrogen bond donor(s) and 3 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 AB00332344-11?
The CAS number of AB00332344-11 is 618396-98-8.
What is the molecular formula of AB00332344-11?
The molecular formula of AB00332344-11 is C17H15BrN2O3S.
What is the molecular weight of AB00332344-11?
The molecular weight of AB00332344-11 is 406.00 g/mol.
Where can I buy AB00332344-11?
You can request a quote for AB00332344-11 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00332344-11?
Yes, KEHONG BIO provides custom synthesis services for AB00332344-11 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.