MGW8PWG95L
TL;DR: MGW8PWG95L (CAS 744953-91-1) is a chemical compound with molecular formula C28H31NO3S and molecular weight 461.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methoxy-3-phenyl-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-2,3-dihydrothiochromen-4-ol
Also Known As: 7-Methoxy-3-phenyl-4-(4-(2-pyrrolidin-1-ylethoxy)phenyl)-2,3-dihydrothiochromen-4-ol, 2H-1-Benzothiopyran-4-ol, 3,4-dihydro-7-methoxy-3-phenyl-4-(4-(2-(1-pyrrolidinyl)ethoxy)phenyl)-, 3,4-Dihydro-7-methoxy-3-phenyl-4-hydroxy-4-(p-(2-(1-pyrrolidyl)ethoxy)phenyl)-2H-1-benzothiapyran, 7-methoxy-3-phenyl-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]thiochroman-4-ol, 7-methoxy-3-phenyl-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-2,3-dihydrothiochromen-4-ol
| Molecular Formula | C28H31NO3S |
|---|---|
| Molecular Weight | 461.20 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.20245 |
| Heavy Atoms | 33 |
| Complexity | 600.0 |
Chemical Identifiers
| CAS Number | 744953-91-1 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(C(CS2)C3=CC=CC=C3)(C4=CC=C(C=C4)OCCN5CCCC5)O |
| InChIKey | WYFLTFQHHHFXHZ-UHFFFAOYSA-N |
Product Overview
MGW8PWG95L (CAS 744953-91-1), with molecular formula C28H31NO3S and molecular weight 461.20 g/mol. IUPAC: 7-methoxy-3-phenyl-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-2,3-dihydrothiochromen-4-ol.
Chemical Property Profile of MGW8PWG95L
Property Insights of MGW8PWG95L
The XLogP value of 5.1 indicates that MGW8PWG95L is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for MGW8PWG95L. Following Lipinski's Rule of Five, MGW8PWG95L has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MGW8PWG95L?
The CAS number of MGW8PWG95L is 744953-91-1.
What is the molecular formula of MGW8PWG95L?
The molecular formula of MGW8PWG95L is C28H31NO3S.
What is the molecular weight of MGW8PWG95L?
The molecular weight of MGW8PWG95L is 461.20 g/mol.
Where can I buy MGW8PWG95L?
You can request a quote for MGW8PWG95L directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MGW8PWG95L?
Yes, KEHONG BIO provides custom synthesis services for MGW8PWG95L and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.