UPCMLD0ENAT0507-2309:001
TL;DR: UPCMLD0ENAT0507-2309:001 (CAS 378753-08-3) is a chemical compound with molecular formula C18H18N2OS2 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylphenyl)-2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: UPCMLD0ENAT0507-2309:001, F1008-0057, K843-0019, 2-(methylthio)-3-(o-tolyl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 3-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C18H18N2OS2 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 4.35632 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 342.08606 |
| Heavy Atoms | 23 |
| Complexity | 955.54535 |
Chemical Identifiers
| CAS Number | 378753-08-3 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C3=C(N=C2SC)SC4=C3CCCC4 |
Product Overview
UPCMLD0ENAT0507-2309:001 (CAS 378753-08-3), with molecular formula C18H18N2OS2 and molecular weight 342.09 g/mol. IUPAC: 3-(2-methylphenyl)-2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of UPCMLD0ENAT0507-2309:001
Property Insights of UPCMLD0ENAT0507-2309:001
The XLogP value of 4.35632 indicates that UPCMLD0ENAT0507-2309:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, UPCMLD0ENAT0507-2309:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0507-2309:001 has 0 hydrogen bond donor(s) and 4 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 UPCMLD0ENAT0507-2309:001?
The CAS number of UPCMLD0ENAT0507-2309:001 is 378753-08-3.
What is the molecular formula of UPCMLD0ENAT0507-2309:001?
The molecular formula of UPCMLD0ENAT0507-2309:001 is C18H18N2OS2.
What is the molecular weight of UPCMLD0ENAT0507-2309:001?
The molecular weight of UPCMLD0ENAT0507-2309:001 is 342.09 g/mol.
Where can I buy UPCMLD0ENAT0507-2309:001?
You can request a quote for UPCMLD0ENAT0507-2309:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0507-2309:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0507-2309:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.