UPCMLD0ENAT5466081:001
TL;DR: UPCMLD0ENAT5466081:001 (CAS 308294-88-4) is a chemical compound with molecular formula C20H15ClO3S2 and molecular weight 402.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(7-chloro-1,3-benzodioxol-5-yl)-3-phenylsulfanyl-1-thiophen-2-ylpropan-1-one
Also Known As: UPCMLD0ENAT5466081:001, 3-(7-chloro-1,3-benzodioxol-5-yl)-3-(phenylsulfanyl)-1-(thiophen-2-yl)propan-1-one, 3-(7-chloro(2H-benzo[d]1,3-dioxolan-5-yl))-3-phenylthio-1-(2-thienyl)propan-1- one, 3-(7-chloro-1,3-benzodioxol-5-yl)-3-phenylsulfanyl-1-thiophen-2-ylpropan-1-one
| Molecular Formula | C20H15ClO3S2 |
|---|---|
| Molecular Weight | 402.02 g/mol |
| LogP | 6.2366 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.0151 |
| Heavy Atoms | 26 |
| Complexity | 910.31555 |
Chemical Identifiers
| CAS Number | 308294-88-4 |
|---|---|
| SMILES | C1OC2=C(O1)C(=CC(=C2)C(CC(=O)C3=CC=CS3)SC4=CC=CC=C4)Cl |
Product Overview
UPCMLD0ENAT5466081:001 (CAS 308294-88-4), with molecular formula C20H15ClO3S2 and molecular weight 402.02 g/mol. IUPAC: 3-(7-chloro-1,3-benzodioxol-5-yl)-3-phenylsulfanyl-1-thiophen-2-ylpropan-1-one.
Chemical Property Profile of UPCMLD0ENAT5466081:001
Property Insights of UPCMLD0ENAT5466081:001
The XLogP value of 6.2366 indicates that UPCMLD0ENAT5466081:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, UPCMLD0ENAT5466081:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT5466081:001 has 0 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 UPCMLD0ENAT5466081:001?
The CAS number of UPCMLD0ENAT5466081:001 is 308294-88-4.
What is the molecular formula of UPCMLD0ENAT5466081:001?
The molecular formula of UPCMLD0ENAT5466081:001 is C20H15ClO3S2.
What is the molecular weight of UPCMLD0ENAT5466081:001?
The molecular weight of UPCMLD0ENAT5466081:001 is 402.02 g/mol.
Where can I buy UPCMLD0ENAT5466081:001?
You can request a quote for UPCMLD0ENAT5466081:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5466081:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5466081:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.