TimTec1_008325
TL;DR: TimTec1_008325 (CAS 331658-40-3) is a chemical compound with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-methoxyphenyl)-5-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate
Also Known As: TimTec1_008325, BAS 00382659, methyl 4-(4-methoxyphenyl)-5-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate, methyl 6-(4-methoxyphenyl)-5-methyl-2-oxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylate, 4-Pyrimidinecarboxylicacid,1,2,3,6-tetrahydro-6-(4-methoxyphenyl)-5-methyl-2-oxo-,methylester(9CI)
| Molecular Formula | C14H16N2O4 |
|---|---|
| Molecular Weight | 276.11 g/mol |
| LogP | 1.4961 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.111 |
| Heavy Atoms | 20 |
| Complexity | 563.04156 |
Chemical Identifiers
| CAS Number | 331658-40-3 |
|---|---|
| SMILES | CC1=C(NC(=O)NC1C2=CC=C(C=C2)OC)C(=O)OC |
Product Overview
TimTec1_008325 (CAS 331658-40-3), with molecular formula C14H16N2O4 and molecular weight 276.11 g/mol. IUPAC: methyl 4-(4-methoxyphenyl)-5-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-6-carboxylate.
Chemical Property Profile of TimTec1_008325
Property Insights of TimTec1_008325
The XLogP value of 1.4961 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_008325. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_008325. Following Lipinski's Rule of Five, TimTec1_008325 has 2 hydrogen bond donor(s) and 4 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 TimTec1_008325?
The CAS number of TimTec1_008325 is 331658-40-3.
What is the molecular formula of TimTec1_008325?
The molecular formula of TimTec1_008325 is C14H16N2O4.
What is the molecular weight of TimTec1_008325?
The molecular weight of TimTec1_008325 is 276.11 g/mol.
Where can I buy TimTec1_008325?
You can request a quote for TimTec1_008325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_008325?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_008325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.