UPCMLD0ENAT5822327:001
TL;DR: UPCMLD0ENAT5822327:001 (CAS 878735-99-0) is a chemical compound with molecular formula C19H18FN5O3 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(4-fluorophenyl)-2-oxoethyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: UPCMLD0ENAT5822327:001, BAS 13030663, F3124-1085, 6-[2-(4-fluorophenyl)-2-oxoethyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione, 8-(2-(4-fluorophenyl)-2-oxoethyl)-1,3,6,7-tetramethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C19H18FN5O3 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 1.32524 |
| Topological Polar Surface Area | 83.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.13937 |
| Heavy Atoms | 28 |
| Complexity | 1386.2048 |
Chemical Identifiers
| CAS Number | 878735-99-0 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC(=O)C4=CC=C(C=C4)F)N(C(=O)N(C3=O)C)C)C |
Product Overview
UPCMLD0ENAT5822327:001 (CAS 878735-99-0), with molecular formula C19H18FN5O3 and molecular weight 383.14 g/mol. IUPAC: 6-[2-(4-fluorophenyl)-2-oxoethyl]-2,4,7,8-tetramethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of UPCMLD0ENAT5822327:001
Property Insights of UPCMLD0ENAT5822327:001
The XLogP value of 1.32524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5822327:001. The TPSA of 83.3 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5822327:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5822327:001 has 0 hydrogen bond donor(s) and 4 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 UPCMLD0ENAT5822327:001?
The CAS number of UPCMLD0ENAT5822327:001 is 878735-99-0.
What is the molecular formula of UPCMLD0ENAT5822327:001?
The molecular formula of UPCMLD0ENAT5822327:001 is C19H18FN5O3.
What is the molecular weight of UPCMLD0ENAT5822327:001?
The molecular weight of UPCMLD0ENAT5822327:001 is 383.14 g/mol.
Where can I buy UPCMLD0ENAT5822327:001?
You can request a quote for UPCMLD0ENAT5822327:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5822327:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5822327:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.