UPCMLD0ENAT5804126:001
TL;DR: UPCMLD0ENAT5804126:001 (CAS 876151-09-6) is a chemical compound with molecular formula C18H21N5O5 and molecular weight 387.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[9-(furan-2-ylmethyl)-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetate
Also Known As: UPCMLD0ENAT5804126:001, ethyl 2-[9-(furan-2-ylmethyl)-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetate, F2013-0257, ethyl 2-(9-(furan-2-ylmethyl)-1-methyl-2,4-dioxo-1,2,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(4H)-yl)acetate, ethyl 2-[9-(2-furylmethyl)-1-methyl-2,4-dioxo-1,3,5-trihydro-6H,7H,8H-1,3-diaz aperhydroino[1,2-h]purin-3-yl]acetate
| Molecular Formula | C18H21N5O5 |
|---|---|
| Molecular Weight | 387.15 g/mol |
| LogP | 0.4631 |
| Topological Polar Surface Area | 104.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.15427 |
| Heavy Atoms | 28 |
| Complexity | 1138.0182 |
Chemical Identifiers
| CAS Number | 876151-09-6 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)C2=C(N=C3N2CCCN3CC4=CC=CO4)N(C1=O)C |
Product Overview
UPCMLD0ENAT5804126:001 (CAS 876151-09-6), with molecular formula C18H21N5O5 and molecular weight 387.15 g/mol. IUPAC: ethyl 2-[9-(furan-2-ylmethyl)-1-methyl-2,4-dioxo-7,8-dihydro-6H-purino[7,8-a]pyrimidin-3-yl]acetate.
Chemical Property Profile of UPCMLD0ENAT5804126:001
Property Insights of UPCMLD0ENAT5804126:001
The XLogP value of 0.4631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5804126:001. The TPSA of 104.5 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5804126:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5804126:001 has 0 hydrogen bond donor(s) and 7 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 UPCMLD0ENAT5804126:001?
The CAS number of UPCMLD0ENAT5804126:001 is 876151-09-6.
What is the molecular formula of UPCMLD0ENAT5804126:001?
The molecular formula of UPCMLD0ENAT5804126:001 is C18H21N5O5.
What is the molecular weight of UPCMLD0ENAT5804126:001?
The molecular weight of UPCMLD0ENAT5804126:001 is 387.15 g/mol.
Where can I buy UPCMLD0ENAT5804126:001?
You can request a quote for UPCMLD0ENAT5804126:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5804126:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5804126:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.