6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one
TL;DR: 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one (CAS 117535-80-5) is a chemical compound with molecular formula C23H19NOS and molecular weight 357.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-anilino-2,5-diphenyl-2,3-dihydrothiopyran-4-one
Also Known As: 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one, 6-anilino-2,5-diphenyl-2,3-dihydrothiopyran-4-one, 12E-914, 2,5-diphenyl-6-(phenylamino)-3,4-dihydro-2H-thiopyran-4-one
| Molecular Formula | C23H19NOS |
|---|---|
| Molecular Weight | 357.12 g/mol |
| LogP | 5.9146 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.11874 |
| Heavy Atoms | 26 |
| Complexity | 920.1961 |
Chemical Identifiers
| CAS Number | 117535-80-5 |
|---|---|
| SMILES | C1C(SC(=C(C1=O)C2=CC=CC=C2)NC3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one (CAS 117535-80-5), with molecular formula C23H19NOS and molecular weight 357.12 g/mol. IUPAC: 6-anilino-2,5-diphenyl-2,3-dihydrothiopyran-4-one.
Chemical Property Profile of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one
Property Insights of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one
The XLogP value of 5.9146 indicates that 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one?
The CAS number of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one is 117535-80-5.
What is the molecular formula of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one?
The molecular formula of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one is C23H19NOS.
What is the molecular weight of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one?
The molecular weight of 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one is 357.12 g/mol.
Where can I buy 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one?
You can request a quote for 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-anilino-2,5-diphenyl-2,3-dihydro-4H-thiopyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.