UPCMLD0ENAT0517-7373:001
TL;DR: UPCMLD0ENAT0517-7373:001 (CAS 568568-58-1) is a chemical compound with molecular formula C19H20N2OS2 and molecular weight 356.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3-(2-phenylethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: UPCMLD0ENAT0517-7373:001, 11-Methyl-4-(2-phenylethyl)-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one, 2-Mercapto-7-methyl-3-phenethyl-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one, 7-methyl-3-(2-phenylethyl)-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-Mercapto-7-methyl-3-phenethyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3h)-one
| Molecular Formula | C19H20N2OS2 |
|---|---|
| Molecular Weight | 356.10 g/mol |
| LogP | 4.48809 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.1017 |
| Heavy Atoms | 24 |
| Complexity | 997.8641 |
Chemical Identifiers
| CAS Number | 568568-58-1 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C(=S)N3)CCC4=CC=CC=C4 |
Product Overview
UPCMLD0ENAT0517-7373:001 (CAS 568568-58-1), with molecular formula C19H20N2OS2 and molecular weight 356.10 g/mol. IUPAC: 7-methyl-3-(2-phenylethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of UPCMLD0ENAT0517-7373:001
Property Insights of UPCMLD0ENAT0517-7373:001
The XLogP value of 4.48809 indicates that UPCMLD0ENAT0517-7373:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, UPCMLD0ENAT0517-7373:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0517-7373:001 has 1 hydrogen bond donor(s) and 3 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 UPCMLD0ENAT0517-7373:001?
The CAS number of UPCMLD0ENAT0517-7373:001 is 568568-58-1.
What is the molecular formula of UPCMLD0ENAT0517-7373:001?
The molecular formula of UPCMLD0ENAT0517-7373:001 is C19H20N2OS2.
What is the molecular weight of UPCMLD0ENAT0517-7373:001?
The molecular weight of UPCMLD0ENAT0517-7373:001 is 356.10 g/mol.
Where can I buy UPCMLD0ENAT0517-7373:001?
You can request a quote for UPCMLD0ENAT0517-7373:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0517-7373:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0517-7373:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.