UPCMLD0ENAT5830782:001
TL;DR: UPCMLD0ENAT5830782:001 (CAS 372971-65-8) is a chemical compound with molecular formula C18H28N4O2S and molecular weight 364.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-heptylsulfanyl-1,3-dimethyl-7-(2-methylprop-2-enyl)purine-2,6-dione
Also Known As: UPCMLD0ENAT5830782:001, 8-heptylsulfanyl-1,3-dimethyl-7-(2-methylprop-2-enyl)purine-2,6-dione, 8-(heptylsulfanyl)-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione, 8-(HEPTYLTHIO)-1,3-DIMETHYL-7-(2-ME-2-PROPENYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 8-(heptylthio)-1,3-dimethyl-7-(2-methylallyl)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C18H28N4O2S |
|---|---|
| Molecular Weight | 364.19 g/mol |
| LogP | 3.0723 |
| Topological Polar Surface Area | 61.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 364.1933 |
| Heavy Atoms | 25 |
| Complexity | 875.79913 |
Chemical Identifiers
| CAS Number | 372971-65-8 |
|---|---|
| SMILES | CCCCCCCSC1=NC2=C(N1CC(=C)C)C(=O)N(C(=O)N2C)C |
Product Overview
UPCMLD0ENAT5830782:001 (CAS 372971-65-8), with molecular formula C18H28N4O2S and molecular weight 364.19 g/mol. IUPAC: 8-heptylsulfanyl-1,3-dimethyl-7-(2-methylprop-2-enyl)purine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5830782:001
Property Insights of UPCMLD0ENAT5830782:001
The XLogP value of 3.0723 indicates that UPCMLD0ENAT5830782:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.82 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5830782:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5830782:001 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 UPCMLD0ENAT5830782:001?
The CAS number of UPCMLD0ENAT5830782:001 is 372971-65-8.
What is the molecular formula of UPCMLD0ENAT5830782:001?
The molecular formula of UPCMLD0ENAT5830782:001 is C18H28N4O2S.
What is the molecular weight of UPCMLD0ENAT5830782:001?
The molecular weight of UPCMLD0ENAT5830782:001 is 364.19 g/mol.
Where can I buy UPCMLD0ENAT5830782:001?
You can request a quote for UPCMLD0ENAT5830782:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5830782:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5830782:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.