UPCMLD0ENAT5730983:001
TL;DR: UPCMLD0ENAT5730983:001 (CAS 476482-91-4) is a chemical compound with molecular formula C16H20N6O3S2 and molecular weight 408.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-7-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethyl]-8-morpholin-4-ylpurine-2,6-dione
Also Known As: UPCMLD0ENAT5730983:001, 3-methyl-7-(2-((4-methylthiazol-2-yl)thio)ethyl)-8-morpholino-1H-purine-2,6(3H,7H)-dione, 3-methyl-7-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethyl]-8-morpholin-4-ylpurine-2,6-dione, 3-METHYL-7-{2-[(4-METHYL-1,3-THIAZOL-2-YL)SULFANYL]ETHYL}-8-(4-MORPHOLINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 3-METHYL-7-(2-((4-METHYL-1,3-THIAZOL-2-YL)SULFANYL)ETHYL)-8-(4-MORPHOLINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C16H20N6O3S2 |
|---|---|
| Molecular Weight | 408.10 g/mol |
| LogP | 0.81712 |
| Topological Polar Surface Area | 98.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.10382 |
| Heavy Atoms | 27 |
| Complexity | 1076.186 |
Chemical Identifiers
| CAS Number | 476482-91-4 |
|---|---|
| SMILES | CC1=CSC(=N1)SCCN2C3=C(N=C2N4CCOCC4)N(C(=O)NC3=O)C |
Product Overview
UPCMLD0ENAT5730983:001 (CAS 476482-91-4), with molecular formula C16H20N6O3S2 and molecular weight 408.10 g/mol. IUPAC: 3-methyl-7-[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]ethyl]-8-morpholin-4-ylpurine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5730983:001
Property Insights of UPCMLD0ENAT5730983:001
The XLogP value of 0.81712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5730983:001. The TPSA of 98.04 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5730983:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5730983:001 has 1 hydrogen bond donor(s) and 8 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 UPCMLD0ENAT5730983:001?
The CAS number of UPCMLD0ENAT5730983:001 is 476482-91-4.
What is the molecular formula of UPCMLD0ENAT5730983:001?
The molecular formula of UPCMLD0ENAT5730983:001 is C16H20N6O3S2.
What is the molecular weight of UPCMLD0ENAT5730983:001?
The molecular weight of UPCMLD0ENAT5730983:001 is 408.10 g/mol.
Where can I buy UPCMLD0ENAT5730983:001?
You can request a quote for UPCMLD0ENAT5730983:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5730983:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5730983:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.