UPCMLD0ENAT0505-9639:001
TL;DR: UPCMLD0ENAT0505-9639:001 (CAS 6337-44-6) is a chemical compound with molecular formula C15H16BrN3O6 and molecular weight 413.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethyl 4-(4-bromo-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: UPCMLD0ENAT0505-9639:001, AB00105412-01, 2-methoxyethyl 4-(4-bromo-3-nitro-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 2-methoxyethyl 4-(4-bromo-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C15H16BrN3O6 |
|---|---|
| Molecular Weight | 413.02 g/mol |
| LogP | 2.1748 |
| Topological Polar Surface Area | 119.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.02225 |
| Heavy Atoms | 25 |
| Complexity | 748.7823 |
Chemical Identifiers
| CAS Number | 6337-44-6 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)Br)[N+](=O)[O-])C(=O)OCCOC |
Product Overview
UPCMLD0ENAT0505-9639:001 (CAS 6337-44-6), with molecular formula C15H16BrN3O6 and molecular weight 413.02 g/mol. IUPAC: 2-methoxyethyl 4-(4-bromo-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of UPCMLD0ENAT0505-9639:001
Property Insights of UPCMLD0ENAT0505-9639:001
The XLogP value of 2.1748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT0505-9639:001. The TPSA of 119.8 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0505-9639:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0505-9639:001 has 2 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 UPCMLD0ENAT0505-9639:001?
The CAS number of UPCMLD0ENAT0505-9639:001 is 6337-44-6.
What is the molecular formula of UPCMLD0ENAT0505-9639:001?
The molecular formula of UPCMLD0ENAT0505-9639:001 is C15H16BrN3O6.
What is the molecular weight of UPCMLD0ENAT0505-9639:001?
The molecular weight of UPCMLD0ENAT0505-9639:001 is 413.02 g/mol.
Where can I buy UPCMLD0ENAT0505-9639:001?
You can request a quote for UPCMLD0ENAT0505-9639:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0505-9639:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0505-9639:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.