![2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- structure](/static/products/883/88369-09-9.png)
2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-
TL;DR: 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- (CAS 88369-09-9) is a chemical compound with molecular formula C16H12O2S and molecular weight 268.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzylsulfanylchromen-2-one
Also Known As: 4-benzylsulfanylchromen-2-one, 4-(benzylthio)coumarin, 4-(benzylsulfanyl)-2H-chromen-2-one, 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-, ICCB4_000121
| Molecular Formula | C16H12O2S |
|---|---|
| Molecular Weight | 268.06 g/mol |
| LogP | 4.0853 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.0558 |
| Heavy Atoms | 19 |
| Complexity | 747.2937 |
Chemical Identifiers
| CAS Number | 88369-09-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=CC(=O)OC3=CC=CC=C32 |
Product Overview
2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- (CAS 88369-09-9), with molecular formula C16H12O2S and molecular weight 268.06 g/mol. IUPAC: 4-benzylsulfanylchromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-
Property Insights of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-
The XLogP value of 4.0853 indicates that 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.21 Ų, 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- 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 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-?
The CAS number of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- is 88369-09-9.
What is the molecular formula of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-?
The molecular formula of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- is C16H12O2S.
What is the molecular weight of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-?
The molecular weight of 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- is 268.06 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-?
You can request a quote for 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 4-[(phenylmethyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.