5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole
TL;DR: 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole (CAS 4600-16-2) is a chemical compound with molecular formula C13H13N2PS and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2λ5-benzodiazaphosphole
Also Known As: 5-methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2, 5-methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzod, 5-Methyl-2-phenyl-2,3-dihydro-1H-1,3,2lambda~5~-benzodiazaphosphole-2-thione, 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole
| Molecular Formula | C13H13N2PS |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.0537 |
| Heavy Atoms | 17 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 4600-16-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NP(=S)(N2)C3=CC=CC=C3 |
| InChIKey | NJMKIBUVXYEAGX-UHFFFAOYSA-N |
Product Overview
5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole (CAS 4600-16-2), with molecular formula C13H13N2PS and molecular weight 260.05 g/mol. IUPAC: 5-methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2λ5-benzodiazaphosphole.
Chemical Property Profile of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole
Property Insights of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole
The XLogP value of 4.9 indicates that 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole has 2 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 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole?
The CAS number of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole is 4600-16-2.
What is the molecular formula of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole?
The molecular formula of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole is C13H13N2PS.
What is the molecular weight of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole?
The molecular weight of 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole is 260.05 g/mol.
Where can I buy 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole?
You can request a quote for 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-phenyl-2-sulfanylidene-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.