UPCMLD0ENAT5836649:001
TL;DR: UPCMLD0ENAT5836649:001 (CAS 674294-37-2) is a chemical compound with molecular formula C19H26N8O4S2 and molecular weight 494.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-2,6-dioxopurin-8-yl]piperazine-1-carboxylate
Also Known As: UPCMLD0ENAT5836649:001, AB00686319-01, F1614-0213, ethyl 4-(1,3-dimethyl-7-(2-((5-methyl-1,3,4-thiadiazol-2-yl)thio)ethyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazine-1-carboxylate, ethyl 4-(1,3-dimethyl-7-{2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl}-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazine-1-carboxylate
| Molecular Formula | C19H26N8O4S2 |
|---|---|
| Molecular Weight | 494.15 g/mol |
| LogP | 0.66442 |
| Topological Polar Surface Area | 120.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 494.15186 |
| Heavy Atoms | 33 |
| Complexity | 1285.414 |
Chemical Identifiers
| CAS Number | 674294-37-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C2=NC3=C(N2CCSC4=NN=C(S4)C)C(=O)N(C(=O)N3C)C |
Product Overview
UPCMLD0ENAT5836649:001 (CAS 674294-37-2), with molecular formula C19H26N8O4S2 and molecular weight 494.15 g/mol. IUPAC: ethyl 4-[1,3-dimethyl-7-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-2,6-dioxopurin-8-yl]piperazine-1-carboxylate.
Chemical Property Profile of UPCMLD0ENAT5836649:001
Property Insights of UPCMLD0ENAT5836649:001
The XLogP value of 0.66442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5836649:001. The TPSA of 120.38 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5836649:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5836649:001 has 0 hydrogen bond donor(s) and 10 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 UPCMLD0ENAT5836649:001?
The CAS number of UPCMLD0ENAT5836649:001 is 674294-37-2.
What is the molecular formula of UPCMLD0ENAT5836649:001?
The molecular formula of UPCMLD0ENAT5836649:001 is C19H26N8O4S2.
What is the molecular weight of UPCMLD0ENAT5836649:001?
The molecular weight of UPCMLD0ENAT5836649:001 is 494.15 g/mol.
Where can I buy UPCMLD0ENAT5836649:001?
You can request a quote for UPCMLD0ENAT5836649:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5836649:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5836649:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.