UPCMLD0ENAT5791955:001
TL;DR: UPCMLD0ENAT5791955:001 (CAS 848735-42-2) is a chemical compound with molecular formula C20H16N2O2S and molecular weight 348.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone
Also Known As: UPCMLD0ENAT5791955:001, 2-((2-methylbenzofuro[3,2-d]pyrimidin-4-yl)thio)-1-(p-tolyl)ethanone, 2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone, 2-[(2-methyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone
| Molecular Formula | C20H16N2O2S |
|---|---|
| Molecular Weight | 348.09 g/mol |
| LogP | 4.96784 |
| Topological Polar Surface Area | 55.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.09326 |
| Heavy Atoms | 25 |
| Complexity | 1084.2028 |
Chemical Identifiers
| CAS Number | 848735-42-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CSC2=NC(=NC3=C2OC4=CC=CC=C43)C |
Product Overview
UPCMLD0ENAT5791955:001 (CAS 848735-42-2), with molecular formula C20H16N2O2S and molecular weight 348.09 g/mol. IUPAC: 2-[(2-methyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]-1-(4-methylphenyl)ethanone.
Chemical Property Profile of UPCMLD0ENAT5791955:001
Property Insights of UPCMLD0ENAT5791955:001
The XLogP value of 4.96784 indicates that UPCMLD0ENAT5791955:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.99 Ų, UPCMLD0ENAT5791955:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5791955:001 has 0 hydrogen bond donor(s) and 5 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 UPCMLD0ENAT5791955:001?
The CAS number of UPCMLD0ENAT5791955:001 is 848735-42-2.
What is the molecular formula of UPCMLD0ENAT5791955:001?
The molecular formula of UPCMLD0ENAT5791955:001 is C20H16N2O2S.
What is the molecular weight of UPCMLD0ENAT5791955:001?
The molecular weight of UPCMLD0ENAT5791955:001 is 348.09 g/mol.
Where can I buy UPCMLD0ENAT5791955:001?
You can request a quote for UPCMLD0ENAT5791955:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5791955:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5791955:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.