![(3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone structure](/static/products/577/577787-66-7.png)
(3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone
TL;DR: (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone (CAS 577787-66-7) is a chemical compound with molecular formula C24H18ClNO3S and molecular weight 435.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-1-benzothiophen-2-yl)-[2-(4-methoxyphenyl)-2,4-dihydro-3,1-benzoxazin-1-yl]methanone
Also Known As: (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone, (3-chloro-1-benzothiophen-2-yl)-[2-(4-methoxyphenyl)-2,4-dihydro-3,1-benzoxazin-1-yl]methanone, (3-chlorobenzo[b]thiophen-2-yl)(2-(4-methoxyphenyl)-2,4-dihydro-1H-benzo[d][1,3]oxazin-1-yl)methanone
| Molecular Formula | C24H18ClNO3S |
|---|---|
| Molecular Weight | 435.07 g/mol |
| LogP | 6.4391 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 435.06958 |
| Heavy Atoms | 30 |
| Complexity | 1234.9286 |
Chemical Identifiers
| CAS Number | 577787-66-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2N(C3=CC=CC=C3CO2)C(=O)C4=C(C5=CC=CC=C5S4)Cl |
Product Overview
(3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone (CAS 577787-66-7), with molecular formula C24H18ClNO3S and molecular weight 435.07 g/mol. IUPAC: (3-chloro-1-benzothiophen-2-yl)-[2-(4-methoxyphenyl)-2,4-dihydro-3,1-benzoxazin-1-yl]methanone.
Chemical Property Profile of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone
Property Insights of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone
The XLogP value of 6.4391 indicates that (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone?
The CAS number of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone is 577787-66-7.
What is the molecular formula of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone?
The molecular formula of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone is C24H18ClNO3S.
What is the molecular weight of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone?
The molecular weight of (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone is 435.07 g/mol.
Where can I buy (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone?
You can request a quote for (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-chloro-1-benzothiophen-2-yl)[2-(4-methoxyphenyl)-2H-3,1-benzoxazin-1(4H)-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.