T0501-2261
TL;DR: T0501-2261 (CAS 72600-15-8) is a chemical compound with molecular formula C13H11NOS and molecular weight 229.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)sulfanyliminocyclohexa-2,5-dien-1-one
Also Known As: 4-(4-methylphenyl)sulfanyliminocyclohexa-2,5-dien-1-one, 4-{[(4-methylphenyl)sulfanyl]imino}cyclohexa-2,5-dien-1-one, Cyclohexa-2,5-diene-1,4-dione [S-(4-methylphenyl)thioxime], Benzenesulfenamide,4-methyl-N-(4-oxo-2,5-cyclohexadien-1-ylidene), Benzenesulfenamide, 4-methyl-N-(4-oxo-2,5-cyclohexadien-1-ylidene)-
| Molecular Formula | C13H11NOS |
|---|---|
| Molecular Weight | 229.06 g/mol |
| LogP | 3.13822 |
| Topological Polar Surface Area | 29.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.05614 |
| Heavy Atoms | 16 |
| Complexity | 465.159 |
Chemical Identifiers
| CAS Number | 72600-15-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SN=C2C=CC(=O)C=C2 |
Product Overview
T0501-2261 (CAS 72600-15-8), with molecular formula C13H11NOS and molecular weight 229.06 g/mol. IUPAC: 4-(4-methylphenyl)sulfanyliminocyclohexa-2,5-dien-1-one.
Chemical Property Profile of T0501-2261
Property Insights of T0501-2261
The XLogP value of 3.13822 indicates that T0501-2261 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.43 Ų, T0501-2261 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, T0501-2261 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 T0501-2261?
The CAS number of T0501-2261 is 72600-15-8.
What is the molecular formula of T0501-2261?
The molecular formula of T0501-2261 is C13H11NOS.
What is the molecular weight of T0501-2261?
The molecular weight of T0501-2261 is 229.06 g/mol.
Where can I buy T0501-2261?
You can request a quote for T0501-2261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for T0501-2261?
Yes, KEHONG BIO provides custom synthesis services for T0501-2261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.