BAS 00111571
TL;DR: BAS 00111571 (CAS 296263-06-4) is a chemical compound with molecular formula C20H24N2O5 and molecular weight 372.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methylcyclohexyl) 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00111571, 3-methylcyclohexyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, (3-methylcyclohexyl) 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 3-methylcyclohexyl 4-(benzo[d][1,3]dioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 3-methylcyclohexyl 6-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-4-methyl-2-oxo-1,3,6-t rihydropyrimidine-5-carboxylate
| Molecular Formula | C20H24N2O5 |
|---|---|
| Molecular Weight | 372.17 g/mol |
| LogP | 3.1651 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.16852 |
| Heavy Atoms | 27 |
| Complexity | 803.5618 |
Chemical Identifiers
| CAS Number | 296263-06-4 |
|---|---|
| SMILES | CC1CCCC(C1)OC(=O)C2=C(NC(=O)NC2C3=CC4=C(C=C3)OCO4)C |
Product Overview
BAS 00111571 (CAS 296263-06-4), with molecular formula C20H24N2O5 and molecular weight 372.17 g/mol. IUPAC: (3-methylcyclohexyl) 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00111571
Property Insights of BAS 00111571
The XLogP value of 3.1651 indicates that BAS 00111571 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 00111571. Following Lipinski's Rule of Five, BAS 00111571 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 00111571?
The CAS number of BAS 00111571 is 296263-06-4.
What is the molecular formula of BAS 00111571?
The molecular formula of BAS 00111571 is C20H24N2O5.
What is the molecular weight of BAS 00111571?
The molecular weight of BAS 00111571 is 372.17 g/mol.
Where can I buy BAS 00111571?
You can request a quote for BAS 00111571 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00111571?
Yes, KEHONG BIO provides custom synthesis services for BAS 00111571 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.