ChemDiv1_002716
TL;DR: ChemDiv1_002716 (CAS 312527-75-6) is a chemical compound with molecular formula C25H28N2O6 and molecular weight 452.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 4-(3-methoxy-4-phenylmethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ChemDiv1_002716, BAS 01404153, tetrahydrofuran-2-ylmethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, (OXOLAN-2-YL)METHYL 4-[4-(BENZYLOXY)-3-METHOXYPHENYL]-6-METHYL-2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE, (tetrahydrofuran-2-yl)methyl 4-(4-(benzyloxy)-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C25H28N2O6 |
|---|---|
| Molecular Weight | 452.19 g/mol |
| LogP | 3.6243 |
| Topological Polar Surface Area | 95.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.19473 |
| Heavy Atoms | 33 |
| Complexity | 1030.4476 |
Chemical Identifiers
| CAS Number | 312527-75-6 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)OCC4CCCO4 |
Product Overview
ChemDiv1_002716 (CAS 312527-75-6), with molecular formula C25H28N2O6 and molecular weight 452.19 g/mol. IUPAC: oxolan-2-ylmethyl 4-(3-methoxy-4-phenylmethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ChemDiv1_002716
Property Insights of ChemDiv1_002716
The XLogP value of 3.6243 indicates that ChemDiv1_002716 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.12 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002716. Following Lipinski's Rule of Five, ChemDiv1_002716 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 ChemDiv1_002716?
The CAS number of ChemDiv1_002716 is 312527-75-6.
What is the molecular formula of ChemDiv1_002716?
The molecular formula of ChemDiv1_002716 is C25H28N2O6.
What is the molecular weight of ChemDiv1_002716?
The molecular weight of ChemDiv1_002716 is 452.19 g/mol.
Where can I buy ChemDiv1_002716?
You can request a quote for ChemDiv1_002716 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002716?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002716 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.