UPCMLD0ENAT5822273:001
TL;DR: UPCMLD0ENAT5822273:001 (CAS 878735-65-0) is a chemical compound with molecular formula C18H17ClFN5O2 and molecular weight 389.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2-chloro-6-fluorophenyl)methyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: UPCMLD0ENAT5822273:001, BAS 13030635, 6-[(2-chloro-6-fluorophenyl)methyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione, 8-[(2-chloro-6-fluorophenyl)methyl]-1,3,6,7-tetramethyl-1H,2H,3H,4H,8H-imidazo[1,2-g]purine-2,4-dione, 8-[(6-chloro-2-fluorophenyl)methyl]-1,3,6,7-tetramethyl-1,3,5-trihydro-4-imida zolino[1,2-h]purine-2,4-dione
| Molecular Formula | C18H17ClFN5O2 |
|---|---|
| Molecular Weight | 389.11 g/mol |
| LogP | 2.14404 |
| Topological Polar Surface Area | 66.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 389.10547 |
| Heavy Atoms | 27 |
| Complexity | 1338.5687 |
Chemical Identifiers
| CAS Number | 878735-65-0 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC4=C(C=CC=C4Cl)F)N(C(=O)N(C3=O)C)C)C |
Product Overview
UPCMLD0ENAT5822273:001 (CAS 878735-65-0), with molecular formula C18H17ClFN5O2 and molecular weight 389.11 g/mol. IUPAC: 6-[(2-chloro-6-fluorophenyl)methyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of UPCMLD0ENAT5822273:001
Property Insights of UPCMLD0ENAT5822273:001
The XLogP value of 2.14404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5822273:001. The TPSA of 66.23 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5822273:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5822273:001 has 0 hydrogen bond donor(s) and 3 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 UPCMLD0ENAT5822273:001?
The CAS number of UPCMLD0ENAT5822273:001 is 878735-65-0.
What is the molecular formula of UPCMLD0ENAT5822273:001?
The molecular formula of UPCMLD0ENAT5822273:001 is C18H17ClFN5O2.
What is the molecular weight of UPCMLD0ENAT5822273:001?
The molecular weight of UPCMLD0ENAT5822273:001 is 389.11 g/mol.
Where can I buy UPCMLD0ENAT5822273:001?
You can request a quote for UPCMLD0ENAT5822273:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5822273:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5822273:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.