BAS 05882001
TL;DR: BAS 05882001 (CAS 445016-00-2) is a chemical compound with molecular formula C18H21ClN2O5 and molecular weight 380.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 05882001, methyl 4-[4-(allyloxy)-3-chloro-5-ethoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, methyl 4-(3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, methyl 4-(4-(allyloxy)-3-chloro-5-ethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, methyl 4-[3-chloro-5-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C18H21ClN2O5 |
|---|---|
| Molecular Weight | 380.11 g/mol |
| LogP | 3.1044 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.1139 |
| Heavy Atoms | 26 |
| Complexity | 760.1935 |
Chemical Identifiers
| CAS Number | 445016-00-2 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)OC)Cl)OCC=C |
Product Overview
BAS 05882001 (CAS 445016-00-2), with molecular formula C18H21ClN2O5 and molecular weight 380.11 g/mol. IUPAC: methyl 4-(3-chloro-5-ethoxy-4-prop-2-enoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 05882001
Property Insights of BAS 05882001
The XLogP value of 3.1044 indicates that BAS 05882001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05882001. Following Lipinski's Rule of Five, BAS 05882001 has 2 hydrogen bond donor(s) and 5 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 BAS 05882001?
The CAS number of BAS 05882001 is 445016-00-2.
What is the molecular formula of BAS 05882001?
The molecular formula of BAS 05882001 is C18H21ClN2O5.
What is the molecular weight of BAS 05882001?
The molecular weight of BAS 05882001 is 380.11 g/mol.
Where can I buy BAS 05882001?
You can request a quote for BAS 05882001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05882001?
Yes, KEHONG BIO provides custom synthesis services for BAS 05882001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.