UPCMLD0ENAT5839947:001
TL;DR: UPCMLD0ENAT5839947:001 (CAS 851940-43-7) is a chemical compound with molecular formula C18H27N5O4 and molecular weight 377.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetate
Also Known As: UPCMLD0ENAT5839947:001, methyl 2-[8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetate, methyl {8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate, methyl 2-{8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl}acetate, methyl 2-{8-[(3,5-dimethylpiperidyl)methyl]-1,3-dimethyl-2,6-dioxo-1,3,7-trihy dropurin-7-yl}acetate
| Molecular Formula | C18H27N5O4 |
|---|---|
| Molecular Weight | 377.21 g/mol |
| LogP | 0.0846 |
| Topological Polar Surface Area | 91.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.2063 |
| Heavy Atoms | 27 |
| Complexity | 976.26917 |
Chemical Identifiers
| CAS Number | 851940-43-7 |
|---|---|
| SMILES | CC1CC(CN(C1)CC2=NC3=C(N2CC(=O)OC)C(=O)N(C(=O)N3C)C)C |
Product Overview
UPCMLD0ENAT5839947:001 (CAS 851940-43-7), with molecular formula C18H27N5O4 and molecular weight 377.21 g/mol. IUPAC: methyl 2-[8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-2,6-dioxopurin-7-yl]acetate.
Chemical Property Profile of UPCMLD0ENAT5839947:001
Property Insights of UPCMLD0ENAT5839947:001
The XLogP value of 0.0846 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5839947:001. The TPSA of 91.36 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5839947:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5839947:001 has 0 hydrogen bond donor(s) and 6 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 UPCMLD0ENAT5839947:001?
The CAS number of UPCMLD0ENAT5839947:001 is 851940-43-7.
What is the molecular formula of UPCMLD0ENAT5839947:001?
The molecular formula of UPCMLD0ENAT5839947:001 is C18H27N5O4.
What is the molecular weight of UPCMLD0ENAT5839947:001?
The molecular weight of UPCMLD0ENAT5839947:001 is 377.21 g/mol.
Where can I buy UPCMLD0ENAT5839947:001?
You can request a quote for UPCMLD0ENAT5839947:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5839947:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5839947:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.