AB00723646-01
TL;DR: AB00723646-01 (CAS 744259-10-7) is a chemical compound with molecular formula C18H20BrN3O5 and molecular weight 437.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-amino-1-methyl-3-(2-methylpropyl)-2,6-dioxopyrimidin-5-yl]-2-oxoethyl] 4-bromobenzoate
Also Known As: AB00723646-01, [2-[4-amino-1-methyl-3-(2-methylpropyl)-2,6-dioxopyrimidin-5-yl]-2-oxoethyl] 4-bromobenzoate, [2-[4-amino-1-methyl-3-(2-methylpropyl)-2,6-dioxo-pyrimidin-5-yl]-2-oxo-ethyl] 4-bromobenzoate, 2-[6-amino-3-methyl-1-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl]-2-oxoethyl 4-bromobenzoate
| Molecular Formula | C18H20BrN3O5 |
|---|---|
| Molecular Weight | 437.06 g/mol |
| LogP | 1.5874 |
| Topological Polar Surface Area | 113.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.05862 |
| Heavy Atoms | 27 |
| Complexity | 989.7823 |
Chemical Identifiers
| CAS Number | 744259-10-7 |
|---|---|
| SMILES | CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)COC(=O)C2=CC=C(C=C2)Br)N |
Product Overview
AB00723646-01 (CAS 744259-10-7), with molecular formula C18H20BrN3O5 and molecular weight 437.06 g/mol. IUPAC: [2-[4-amino-1-methyl-3-(2-methylpropyl)-2,6-dioxopyrimidin-5-yl]-2-oxoethyl] 4-bromobenzoate.
Chemical Property Profile of AB00723646-01
Property Insights of AB00723646-01
The XLogP value of 1.5874 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00723646-01. The TPSA of 113.39 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00723646-01. Following Lipinski's Rule of Five, AB00723646-01 has 1 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 AB00723646-01?
The CAS number of AB00723646-01 is 744259-10-7.
What is the molecular formula of AB00723646-01?
The molecular formula of AB00723646-01 is C18H20BrN3O5.
What is the molecular weight of AB00723646-01?
The molecular weight of AB00723646-01 is 437.06 g/mol.
Where can I buy AB00723646-01?
You can request a quote for AB00723646-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00723646-01?
Yes, KEHONG BIO provides custom synthesis services for AB00723646-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.