UPCMLD0ENAT0504-0529:001
TL;DR: UPCMLD0ENAT0504-0529:001 (CAS 308294-74-8) is a chemical compound with molecular formula C25H23ClO3S and molecular weight 438.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)sulfanyl-(3,4-dimethoxyphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-one
Also Known As: UPCMLD0ENAT0504-0529:001, F0870-0022, 2-(((4-chlorophenyl)thio)(3,4-dimethoxyphenyl)methyl)-3,4-dihydronaphthalen-1(2H)-one, 2-{[(4-chlorophenyl)sulfanyl](3,4-dimethoxyphenyl)methyl}-1,2,3,4-tetrahydronaphthalen-1-one, 2-[(4-chlorophenyl)sulfanyl-(3,4-dimethoxyphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-one
| Molecular Formula | C25H23ClO3S |
|---|---|
| Molecular Weight | 438.11 g/mol |
| LogP | 6.6359 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.10565 |
| Heavy Atoms | 30 |
| Complexity | 1048.5143 |
Chemical Identifiers
| CAS Number | 308294-74-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(C2CCC3=CC=CC=C3C2=O)SC4=CC=C(C=C4)Cl)OC |
Product Overview
UPCMLD0ENAT0504-0529:001 (CAS 308294-74-8), with molecular formula C25H23ClO3S and molecular weight 438.11 g/mol. IUPAC: 2-[(4-chlorophenyl)sulfanyl-(3,4-dimethoxyphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-one.
Chemical Property Profile of UPCMLD0ENAT0504-0529:001
Property Insights of UPCMLD0ENAT0504-0529:001
The XLogP value of 6.6359 indicates that UPCMLD0ENAT0504-0529:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, UPCMLD0ENAT0504-0529:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0504-0529:001 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 UPCMLD0ENAT0504-0529:001?
The CAS number of UPCMLD0ENAT0504-0529:001 is 308294-74-8.
What is the molecular formula of UPCMLD0ENAT0504-0529:001?
The molecular formula of UPCMLD0ENAT0504-0529:001 is C25H23ClO3S.
What is the molecular weight of UPCMLD0ENAT0504-0529:001?
The molecular weight of UPCMLD0ENAT0504-0529:001 is 438.11 g/mol.
Where can I buy UPCMLD0ENAT0504-0529:001?
You can request a quote for UPCMLD0ENAT0504-0529:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0504-0529:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0504-0529:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.