BAS 00547240
TL;DR: BAS 00547240 (CAS 301319-95-9) is a chemical compound with molecular formula C15H15N3O7 and molecular weight 349.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: BAS 00547240, BIM-0025725.P001, AB00090349-01, methyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate, methyl 1,6-dimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C15H15N3O7 |
|---|---|
| Molecular Weight | 349.09 g/mol |
| LogP | 1.4666 |
| Topological Polar Surface Area | 120.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.091 |
| Heavy Atoms | 25 |
| Complexity | 817.5882 |
Chemical Identifiers
| CAS Number | 301319-95-9 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1C)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C(=O)OC |
Product Overview
BAS 00547240 (CAS 301319-95-9), with molecular formula C15H15N3O7 and molecular weight 349.09 g/mol. IUPAC: methyl 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00547240
Property Insights of BAS 00547240
The XLogP value of 1.4666 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00547240. The TPSA of 120.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00547240. Following Lipinski's Rule of Five, BAS 00547240 has 1 hydrogen bond donor(s) and 7 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 00547240?
The CAS number of BAS 00547240 is 301319-95-9.
What is the molecular formula of BAS 00547240?
The molecular formula of BAS 00547240 is C15H15N3O7.
What is the molecular weight of BAS 00547240?
The molecular weight of BAS 00547240 is 349.09 g/mol.
Where can I buy BAS 00547240?
You can request a quote for BAS 00547240 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00547240?
Yes, KEHONG BIO provides custom synthesis services for BAS 00547240 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.